4-(4-methylphenyl)-5-oxidanylidene-2-pyrrol-1-yl-4,6,7,8-tetrahydrochromene-3-carbonitrile

Systemtic Name: 4-(4-methylphenyl)-5-oxidanylidene-2-pyrrol-1-yl-4,6,7,8-tetrahydrochromene-3-carbonitrile Openeye Name: 5-oxo-4-(p-tolyl)-2-pyrrol-1-yl-4,6,7,8-tetrahydrochromene-3-carbonitrile CAS Name: 4-(4-methylphenyl)-5-oxo-2-(1-pyrrolyl)-4,6,7,8-tetrahydro-1-benzopyran-3-carbonitrile IUPAC Name: 4-(4-methylphenyl)-5-oxo-2-pyrrol-1-yl-4,6,7,8-tetrahydrochromene-3-carbonitrile Traditional Name: 5-keto-4-(p-tolyl)-2-pyrrol-1-yl-4,6,7,8-tetrahydrochromene-3-carbonitrile Formula: C21H18N2O2 MolecularWeight: 330.37982

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2C(=C(OC3=C2C(=O)CCC3)N4C=CC=C4)C#N

Isomeric SMILES

CC1=CC=C(C=C1)C2C(=C(OC3=C2C(=O)CCC3)N4C=CC=C4)C#N

InChI

InChI=1S/C21H18N2O2/c1-14-7-9-15(10-8-14)19-16(13-22)21(23-11-2-3-12-23)25-18-6-4-5-17(24)20(18)19/h2-3,7-12,19H,4-6H2,1H3