3-[(Z)-[4-isocyano-3-(4-methylphenyl)-5-oxidanylidene-furan-2-ylidene]methyl]-1H-indole-6-carboxylic acid

Systemtic Name: 3-[(Z)-[4-isocyano-3-(4-methylphenyl)-5-oxidanylidene-furan-2-ylidene]methyl]-1H-indole-6-carboxylic acid Openeye Name: 3-[(Z)-[4-isocyano-5-oxo-3-(p-tolyl)-2-furylidene]methyl]-1H-indole-6-carboxylic acid CAS Name: 3-[(Z)-[4-isocyano-3-(4-methylphenyl)-5-oxo-2-furanylidene]methyl]-1H-indole-6-carboxylic acid IUPAC Name: 3-[(Z)-[4-isocyano-3-(4-methylphenyl)-5-oxofuran-2-ylidene]methyl]-1H-indole-6-carboxylic acid Traditional Name: 3-[(Z)-[4-isocyano-5-keto-3-(p-tolyl)-2-furylidene]methyl]-1H-indole-6-carboxylic acid Formula: C22H14N2O4 MolecularWeight: 370.35756

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(C(=O)OC2=CC3=CNC4=C3C=CC(=C4)C(=O)O)[N+]#[C-]

Isomeric SMILES

CC1=CC=C(C=C1)C\2=C(C(=O)O/C2=C\C3=CNC4=C3C=CC(=C4)C(=O)O)[N+]#[C-]

InChI

InChI=1S/C22H14N2O4/c1-12-3-5-13(6-4-12)19-18(28-22(27)20(19)23-2)10-15-11-24-17-9-14(21(25)26)7-8-16(15)17/h3-11,24H,1H3,(H,25,26)/b18-10-