[4-[(E)-[(3-chloranyl-1-benzothiophen-2-yl)carbonylhydrazinylidene]methyl]phenyl] 4-methylbenzoate

Systemtic Name: [4-[(E)-[(3-chloranyl-1-benzothiophen-2-yl)carbonylhydrazinylidene]methyl]phenyl] 4-methylbenzoate Openeye Name: [4-[(E)-[(3-chlorobenzothiophene-2-carbonyl)hydrazono]methyl]phenyl] 4-methylbenzoate CAS Name: 4-methylbenzoic acid [4-[(E)-[[(3-chloro-1-benzothiophen-2-yl)-oxomethyl]hydrazinylidene]methyl]phenyl] ester IUPAC Name: [4-[(E)-[(3-chloro-1-benzothiophene-2-carbonyl)hydrazinylidene]methyl]phenyl] 4-methylbenzoate Traditional Name: 4-methylbenzoic acid [4-[(E)-[(3-chlorobenzothiophene-2-carbonyl)hydrazono]methyl]phenyl] ester Formula: C24H17ClN2O3S MolecularWeight: 448.92138

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C=NNC(=O)C3=C(C4=CC=CC=C4S3)Cl

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)/C=N/NC(=O)C3=C(C4=CC=CC=C4S3)Cl

InChI

InChI=1S/C24H17ClN2O3S/c1-15-6-10-17(11-7-15)24(29)30-18-12-8-16(9-13-18)14-26-27-23(28)22-21(25)19-4-2-3-5-20(19)31-22/h2-14H,1H3,(H,27,28)/b26-14+