769152-34-3
1-(2-(OXO(4-TOLUIDINO)ACETYL)CARBOHYDRAZONOYL)-2-NAPHTHYL 4-METHOXYBENZOATE
Name1-(2-(OXO(4-TOLUIDINO)ACETYL)CARBOHYDRAZONOYL)-2-NAPHTHYL 4-METHOXYBENZOATE
1Identification
【Name】
1-(2-(OXO(4-TOLUIDINO)ACETYL)CARBOHYDRAZONOYL)-2-NAPHTHYL 4-METHOXYBENZOATE
【CAS】
【MDL】
MFCD05153558
【English Synonyms】
【Formula】
C28 H23 N3 O5
【MolWeight】
481.506
【Inchi】
InChI=1S/C28H23N3O5/c1-18-7-12-21(13-8-18)30-26(32)27(33)31-29-17-24-23-6-4-3-5-19(23)11-16-25(24)36-28(34)20-9-14-22(35-2)15-10-20/h3-17H,1-2H3,(H,30,32)(H,31,33)/b29-17+
【InChIKey】
InChIKey=MFZZRVGXYJGLPC-STBIYBPSSA-N
【SMILES】
Cc1ccc(cc1)NC(=O)C(=O)N/N=C/c2c3ccccc3ccc2OC(=O)c4ccc(cc4)OC
【MOL File】
1-(2-(OXO(4-TOLUIDIN….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:8
XLogP3:4.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
1-(2-(OXO(4-TOLUIDINO)ACETYL)CARBOHYDRAZONOYL)-2-NAPHTHYL 4-METHOXYBENZOATE.cml