4-azanyl-5-(4-nitrophenyl)carbonyl-2-phenylazanyl-thiophene-3-carboxylic acid

Systemtic Name: 4-azanyl-5-(4-nitrophenyl)carbonyl-2-phenylazanyl-thiophene-3-carboxylic acid Openeye Name: 4-amino-2-anilino-5-(4-nitrobenzoyl)thiophene-3-carboxylic acid CAS Name: 4-amino-2-anilino-5-[(4-nitrophenyl)-oxomethyl]-3-thiophenecarboxylic acid IUPAC Name: 4-amino-2-anilino-5-(4-nitrobenzoyl)thiophene-3-carboxylic acid Traditional Name: 4-amino-2-anilino-5-(4-nitrobenzoyl)-3-thenoic acid Formula: C18H13N3O5S MolecularWeight: 383.37792

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC2=C(C(=C(S2)C(=O)C3=CC=C(C=C3)[N+](=O)[O-])N)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)NC2=C(C(=C(S2)C(=O)C3=CC=C(C=C3)[N+](=O)[O-])N)C(=O)O

InChI

InChI=1S/C18H13N3O5S/c19-14-13(18(23)24)17(20-11-4-2-1-3-5-11)27-16(14)15(22)10-6-8-12(9-7-10)21(25)26/h1-9,20H,19H2,(H,23,24)