3-[4-imidazol-1-yl-1-methyl-2,5-bis(oxidanylidene)pyrrol-3-yl]indole-1-carboxylic acid

Systemtic Name: 3-[4-imidazol-1-yl-1-methyl-2,5-bis(oxidanylidene)pyrrol-3-yl]indole-1-carboxylic acid Openeye Name: 3-(4-imidazol-1-yl-1-methyl-2,5-dioxo-pyrrol-3-yl)indole-1-carboxylic acid CAS Name: 3-[4-(1-imidazolyl)-1-methyl-2,5-dioxo-3-pyrrolyl]-1-indolecarboxylic acid IUPAC Name: 3-(4-imidazol-1-yl-1-methyl-2,5-dioxopyrrol-3-yl)indole-1-carboxylic acid Traditional Name: 3-(4-imidazol-1-yl-2,5-diketo-1-methyl-3-pyrrolin-3-yl)indole-1-carboxylic acid Formula: C17H12N4O4 MolecularWeight: 336.30158

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C(=C(C1=O)N2C=CN=C2)C3=CN(C4=CC=CC=C43)C(=O)O

Isomeric SMILES

CN1C(=O)C(=C(C1=O)N2C=CN=C2)C3=CN(C4=CC=CC=C43)C(=O)O

InChI

InChI=1S/C17H12N4O4/c1-19-15(22)13(14(16(19)23)20-7-6-18-9-20)11-8-21(17(24)25)12-5-3-2-4-10(11)12/h2-9H,1H3,(H,24,25)