769148-27-8
1-(2-(ANILINO(OXO)ACETYL)CARBOHYDRAZONOYL)-2-NAPHTHYL 3-METHYLBENZOATE
Name1-(2-(ANILINO(OXO)ACETYL)CARBOHYDRAZONOYL)-2-NAPHTHYL 3-METHYLBENZOATE
1Identification
【Name】
1-(2-(ANILINO(OXO)ACETYL)CARBOHYDRAZONOYL)-2-NAPHTHYL 3-METHYLBENZOATE
【CAS】
【MDL】
MFCD05154180
【English Synonyms】
【Formula】
C27 H21 N3 O4
【MolWeight】
451.48
【Inchi】
InChI=1S/C27H21N3O4/c1-18-8-7-10-20(16-18)27(33)34-24-15-14-19-9-5-6-13-22(19)23(24)17-28-30-26(32)25(31)29-21-11-3-2-4-12-21/h2-17H,1H3,(H,29,31)(H,30,32)/b28-17+
【InChIKey】
InChIKey=GZRJTNRVNIRBGN-OGLMXYFKSA-N
【SMILES】
Cc1cccc(c1)C(=O)Oc2ccc3ccccc3c2/C=N/NC(=O)C(=O)Nc4ccccc4
【MOL File】
1-(2-(ANILINO(OXO)AC….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:7
XLogP3:4.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
1-(2-(ANILINO(OXO)ACETYL)CARBOHYDRAZONOYL)-2-NAPHTHYL 3-METHYLBENZOATE.cml