(E)-4-[3-[(3-nitrophenyl)carbamoyl]indol-1-yl]-4-oxidanylidene-but-2-enoic acid

Systemtic Name: (E)-4-[3-[(3-nitrophenyl)carbamoyl]indol-1-yl]-4-oxidanylidene-but-2-enoic acid Openeye Name: (E)-4-[3-[(3-nitrophenyl)carbamoyl]indol-1-yl]-4-oxo-but-2-enoic acid CAS Name: (E)-4-[3-[(3-nitroanilino)-oxomethyl]-1-indolyl]-4-oxo-2-butenoic acid IUPAC Name: (E)-4-[3-[(3-nitrophenyl)carbamoyl]indol-1-yl]-4-oxobut-2-enoic acid Traditional Name: (E)-4-keto-4-[3-[(3-nitrophenyl)carbamoyl]indol-1-yl]but-2-enoic acid Formula: C19H13N3O6 MolecularWeight: 379.32302

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2C(=O)C=CC(=O)O)C(=O)NC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2C(=O)/C=C/C(=O)O)C(=O)NC3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H13N3O6/c23-17(8-9-18(24)25)21-11-15(14-6-1-2-7-16(14)21)19(26)20-12-4-3-5-13(10-12)22(27)28/h1-11H,(H,20,26)(H,24,25)/b9-8+