[4-[(E)-[(3-chloranyl-6-methoxy-1-benzothiophen-2-yl)carbonylhydrazinylidene]methyl]phenyl] 3-bromanylbenzoate

Systemtic Name: [4-[(E)-[(3-chloranyl-6-methoxy-1-benzothiophen-2-yl)carbonylhydrazinylidene]methyl]phenyl] 3-bromanylbenzoate Openeye Name: [4-[(E)-[(3-chloro-6-methoxy-benzothiophene-2-carbonyl)hydrazono]methyl]phenyl] 3-bromobenzoate CAS Name: 3-bromobenzoic acid [4-[(E)-[[(3-chloro-6-methoxy-1-benzothiophen-2-yl)-oxomethyl]hydrazinylidene]methyl]phenyl] ester IUPAC Name: [4-[(E)-[(3-chloro-6-methoxy-1-benzothiophene-2-carbonyl)hydrazinylidene]methyl]phenyl] 3-bromobenzoate Traditional Name: 3-bromobenzoic acid [4-[(E)-[(3-chloro-6-methoxy-benzothiophene-2-carbonyl)hydrazono]methyl]phenyl] ester Formula: C24H16BrClN2O4S MolecularWeight: 543.81684

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=C(S2)C(=O)NN=CC3=CC=C(C=C3)OC(=O)C4=CC(=CC=C4)Br)Cl

Isomeric SMILES

COC1=CC2=C(C=C1)C(=C(S2)C(=O)N/N=C/C3=CC=C(C=C3)OC(=O)C4=CC(=CC=C4)Br)Cl

InChI

InChI=1S/C24H16BrClN2O4S/c1-31-18-9-10-19-20(12-18)33-22(21(19)26)23(29)28-27-13-14-5-7-17(8-6-14)32-24(30)15-3-2-4-16(25)11-15/h2-13H,1H3,(H,28,29)/b27-13+