4-(1,3-benzodioxol-5-yl)-1-(3-chloranyl-2-methyl-phenyl)-7,7-dimethyl-5-oxidanylidene-2-pyrrol-1-yl-6,8-dihydro-4H-quinoline-3-carbonitrile

Systemtic Name: 4-(1,3-benzodioxol-5-yl)-1-(3-chloranyl-2-methyl-phenyl)-7,7-dimethyl-5-oxidanylidene-2-pyrrol-1-yl-6,8-dihydro-4H-quinoline-3-carbonitrile Openeye Name: 4-(1,3-benzodioxol-5-yl)-1-(3-chloro-2-methyl-phenyl)-7,7-dimethyl-5-oxo-2-pyrrol-1-yl-6,8-dihydro-4H-quinoline-3-carbonitrile CAS Name: 4-(1,3-benzodioxol-5-yl)-1-(3-chloro-2-methylphenyl)-7,7-dimethyl-5-oxo-2-(1-pyrrolyl)-6,8-dihydro-4H-quinoline-3-carbonitrile IUPAC Name: 4-(1,3-benzodioxol-5-yl)-1-(3-chloro-2-methylphenyl)-7,7-dimethyl-5-oxo-2-pyrrol-1-yl-6,8-dihydro-4H-quinoline-3-carbonitrile Traditional Name: 4-(1,3-benzodioxol-5-yl)-1-(3-chloro-2-methyl-phenyl)-5-keto-7,7-dimethyl-2-pyrrol-1-yl-6,8-dihydro-4H-quinoline-3-carbonitrile Formula: C30H26ClN3O3 MolecularWeight: 511.99874

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)N2C3=C(C(C(=C2N4C=CC=C4)C#N)C5=CC6=C(C=C5)OCO6)C(=O)CC(C3)(C)C

Isomeric SMILES

CC1=C(C=CC=C1Cl)N2C3=C(C(C(=C2N4C=CC=C4)C#N)C5=CC6=C(C=C5)OCO6)C(=O)CC(C3)(C)C

InChI

InChI=1S/C30H26ClN3O3/c1-18-21(31)7-6-8-22(18)34-23-14-30(2,3)15-24(35)28(23)27(19-9-10-25-26(13-19)37-17-36-25)20(16-32)29(34)33-11-4-5-12-33/h4-13,27H,14-15,17H2,1-3H3