2-azanyl-4-(1,3-benzodioxol-5-yl)-7,7-dimethyl-1-(3-methylphenyl)-5-oxidanylidene-6,8-dihydro-4H-quinoline-3-carbonitrile

Systemtic Name: 2-azanyl-4-(1,3-benzodioxol-5-yl)-7,7-dimethyl-1-(3-methylphenyl)-5-oxidanylidene-6,8-dihydro-4H-quinoline-3-carbonitrile Openeye Name: 2-amino-4-(1,3-benzodioxol-5-yl)-7,7-dimethyl-1-(m-tolyl)-5-oxo-6,8-dihydro-4H-quinoline-3-carbonitrile CAS Name: 2-amino-4-(1,3-benzodioxol-5-yl)-7,7-dimethyl-1-(3-methylphenyl)-5-oxo-6,8-dihydro-4H-quinoline-3-carbonitrile IUPAC Name: 2-amino-4-(1,3-benzodioxol-5-yl)-7,7-dimethyl-1-(3-methylphenyl)-5-oxo-6,8-dihydro-4H-quinoline-3-carbonitrile Traditional Name: 2-amino-4-(1,3-benzodioxol-5-yl)-5-keto-7,7-dimethyl-1-(m-tolyl)-6,8-dihydro-4H-quinoline-3-carbonitrile Formula: C26H25N3O3 MolecularWeight: 427.495

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C3=C(C(C(=C2N)C#N)C4=CC5=C(C=C4)OCO5)C(=O)CC(C3)(C)C

Isomeric SMILES

CC1=CC(=CC=C1)N2C3=C(C(C(=C2N)C#N)C4=CC5=C(C=C4)OCO5)C(=O)CC(C3)(C)C

InChI

InChI=1S/C26H25N3O3/c1-15-5-4-6-17(9-15)29-19-11-26(2,3)12-20(30)24(19)23(18(13-27)25(29)28)16-7-8-21-22(10-16)32-14-31-21/h4-10,23H,11-12,14,28H2,1-3H3