[4-[(Z)-(2-thiophen-2-ylethanoylhydrazinylidene)methyl]phenyl] 3-nitrobenzoate

Systemtic Name: [4-[(Z)-(2-thiophen-2-ylethanoylhydrazinylidene)methyl]phenyl] 3-nitrobenzoate Openeye Name: [4-[(Z)-[[2-(2-thienyl)acetyl]hydrazono]methyl]phenyl] 3-nitrobenzoate CAS Name: 3-nitrobenzoic acid [4-[(Z)-[(1-oxo-2-thiophen-2-ylethyl)hydrazinylidene]methyl]phenyl] ester IUPAC Name: [4-[(Z)-[(2-thiophen-2-ylacetyl)hydrazinylidene]methyl]phenyl] 3-nitrobenzoate Traditional Name: 3-nitrobenzoic acid [4-[(Z)-[[2-(2-thienyl)acetyl]hydrazono]methyl]phenyl] ester Formula: C20H15N3O5S MolecularWeight: 409.4152

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)OC2=CC=C(C=C2)C=NNC(=O)CC3=CC=CS3

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)OC2=CC=C(C=C2)/C=N\NC(=O)CC3=CC=CS3

InChI

InChI=1S/C20H15N3O5S/c24-19(12-18-5-2-10-29-18)22-21-13-14-6-8-17(9-7-14)28-20(25)15-3-1-4-16(11-15)23(26)27/h1-11,13H,12H2,(H,22,24)/b21-13-