4-[4-methyl-3-(1-methylindol-4-yl)-1H-1,2,4-triazol-5-ylidene]cyclohexa-2,5-dien-1-one

Systemtic Name: 4-[4-methyl-3-(1-methylindol-4-yl)-1H-1,2,4-triazol-5-ylidene]cyclohexa-2,5-dien-1-one Openeye Name: 4-[4-methyl-3-(1-methylindol-4-yl)-1H-1,2,4-triazol-5-ylidene]cyclohexa-2,5-dien-1-one CAS Name: 4-[4-methyl-3-(1-methyl-4-indolyl)-1H-1,2,4-triazol-5-ylidene]-1-cyclohexa-2,5-dienone IUPAC Name: 4-[4-methyl-3-(1-methylindol-4-yl)-1H-1,2,4-triazol-5-ylidene]cyclohexa-2,5-dien-1-one Traditional Name: 4-[4-methyl-3-(1-methylindol-4-yl)-1H-1,2,4-triazol-5-ylidene]cyclohexa-2,5-dien-1-one Formula: C18H16N4O MolecularWeight: 304.34584

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC2=C(C=CC=C21)C3=NNC(=C4C=CC(=O)C=C4)N3C

Isomeric SMILES

CN1C=CC2=C(C=CC=C21)C3=NNC(=C4C=CC(=O)C=C4)N3C

InChI

InChI=1S/C18H16N4O/c1-21-11-10-14-15(4-3-5-16(14)21)18-20-19-17(22(18)2)12-6-8-13(23)9-7-12/h3-11,19H,1-2H3