394653-95-3
4-[(1H-INDOL-6-YLCARBONYL)AMINO]-BUTANOIC ACID METHYL ESTER
Name4-[(1H-INDOL-6-YLCARBONYL)AMINO]-BUTANOIC ACID METHYL ESTER
1Identification
【Name】
4-[(1H-INDOL-6-YLCARBONYL)AMINO]-BUTANOIC ACID METHYL ESTER
【CAS】
【MDL】
MFCD00214543
【English Synonyms】
【Formula】
C14 H16 N2 O3
【MolWeight】
260.291
【Inchi】
InChI=1S/C14H16N2O3/c1-19-13(17)3-2-7-16-14(18)11-5-4-10-6-8-15-12(10)9-11/h4-6,8-9,15H,2-3,7H2,1H3,(H,16,18)
【InChIKey】
InChIKey=DPCNPOHSJADBNR-UHFFFAOYSA-N
【SMILES】
COC(=O)CCCNC(=O)c1ccc2cc[nH]c2c1
【MOL File】
4-[(1H-INDOL-6-YLCAR….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:5
XLogP3:1.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
4-[(1H-INDOL-6-YLCARBONYL)AMINO]-BUTANOIC ACID METHYL ESTER.cml