38314-47-5
4-CHLORO-2-[(4-ETHOXY-4-OXOBUTYL)[(4-METHYLPHENYL)SULFONYL]AMINO]-BENZOIC ACID METHYL ESTER
Name4-CHLORO-2-[(4-ETHOXY-4-OXOBUTYL)[(4-METHYLPHENYL)SULFONYL]AMINO]-BENZOIC ACID METHYL ESTER
1Identification
【Name】
4-CHLORO-2-[(4-ETHOXY-4-OXOBUTYL)[(4-METHYLPHENYL)SULFONYL]AMINO]-BENZOIC ACID METHYL ESTER
【CAS】
【MDL】
MFCD00666415
【English Synonyms】
【Formula】
C21 H24 Cl N O6 S
【MolWeight】
453.941
【Inchi】
InChI=1S/C21H24ClNO6S/c1-4-29-20(24)6-5-13-23(30(26,27)17-10-7-15(2)8-11-17)19-14-16(22)9-12-18(19)21(25)28-3/h7-12,14H,4-6,13H2,1-3H3
【InChIKey】
InChIKey=RVEASWSNMQMONO-UHFFFAOYSA-N
【SMILES】
CCOC(=O)CCCN(c1cc(ccc1C(=O)OC)Cl)S(=O)(=O)c2ccc(cc2)C
【MOL File】
4-CHLORO-2-[(4-ETHOX….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:7
XLogP3:5.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
4-CHLORO-2-[(4-ETHOXY-4-OXOBUTYL)[(4-METHYLPHENYL)SULFONYL]AMINO]-BENZOIC ACID METHYL ESTER.cml