4-(1,3-benzodioxol-5-yl)-5-oxidanylidene-1-pyridin-3-yl-2-pyrrol-1-yl-4,6,7,8-tetrahydroquinoline-3-carbonitrile

Systemtic Name: 4-(1,3-benzodioxol-5-yl)-5-oxidanylidene-1-pyridin-3-yl-2-pyrrol-1-yl-4,6,7,8-tetrahydroquinoline-3-carbonitrile Openeye Name: 4-(1,3-benzodioxol-5-yl)-5-oxo-1-(3-pyridyl)-2-pyrrol-1-yl-4,6,7,8-tetrahydroquinoline-3-carbonitrile CAS Name: 4-(1,3-benzodioxol-5-yl)-5-oxo-1-(3-pyridinyl)-2-(1-pyrrolyl)-4,6,7,8-tetrahydroquinoline-3-carbonitrile IUPAC Name: 4-(1,3-benzodioxol-5-yl)-5-oxo-1-pyridin-3-yl-2-pyrrol-1-yl-4,6,7,8-tetrahydroquinoline-3-carbonitrile Traditional Name: 4-(1,3-benzodioxol-5-yl)-5-keto-1-(3-pyridyl)-2-pyrrol-1-yl-4,6,7,8-tetrahydroquinoline-3-carbonitrile Formula: C26H20N4O3 MolecularWeight: 436.462

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C(C(=C(N2C3=CN=CC=C3)N4C=CC=C4)C#N)C5=CC6=C(C=C5)OCO6)C(=O)C1

Isomeric SMILES

C1CC2=C(C(C(=C(N2C3=CN=CC=C3)N4C=CC=C4)C#N)C5=CC6=C(C=C5)OCO6)C(=O)C1

InChI

InChI=1S/C26H20N4O3/c27-14-19-24(17-8-9-22-23(13-17)33-16-32-22)25-20(6-3-7-21(25)31)30(18-5-4-10-28-15-18)26(19)29-11-1-2-12-29/h1-2,4-5,8-13,15,24H,3,6-7,16H2