2-[(E)-N-[(4-nitrophenyl)amino]-C-thiophen-2-yl-carbonimidoyl]indene-1,3-dione

Systemtic Name: 2-[(E)-N-[(4-nitrophenyl)amino]-C-thiophen-2-yl-carbonimidoyl]indene-1,3-dione Openeye Name: 2-[(E)-N-(4-nitroanilino)-C-(2-thienyl)carbonimidoyl]indane-1,3-dione CAS Name: 2-[(E)-[(4-nitrophenyl)hydrazinylidene]-thiophen-2-ylmethyl]indene-1,3-dione IUPAC Name: 2-[(E)-N-(4-nitroanilino)-C-thiophen-2-ylcarbonimidoyl]indene-1,3-dione Traditional Name: 2-[(E)-N-(4-nitroanilino)-C-(2-thienyl)carbonimidoyl]indane-1,3-quinone Formula: C20H13N3O4S MolecularWeight: 391.39992

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)C(C2=O)C(=NNC3=CC=C(C=C3)[N+](=O)[O-])C4=CC=CS4

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)C(C2=O)/C(=N\NC3=CC=C(C=C3)[N+](=O)[O-])/C4=CC=CS4

InChI

InChI=1S/C20H13N3O4S/c24-19-14-4-1-2-5-15(14)20(25)17(19)18(16-6-3-11-28-16)22-21-12-7-9-13(10-8-12)23(26)27/h1-11,17,21H/b22-18-