4-(1,3-benzodioxol-5-yl)-2-[(4-methylphenyl)amino]-5-oxidanylidene-indeno[1,2-b]pyridine-3-carbonitrile

Systemtic Name: 4-(1,3-benzodioxol-5-yl)-2-[(4-methylphenyl)amino]-5-oxidanylidene-indeno[1,2-b]pyridine-3-carbonitrile Openeye Name: 4-(1,3-benzodioxol-5-yl)-2-(4-methylanilino)-5-oxo-indeno[1,2-b]pyridine-3-carbonitrile CAS Name: 4-(1,3-benzodioxol-5-yl)-2-(4-methylanilino)-5-oxo-3-indeno[1,2-b]pyridinecarbonitrile IUPAC Name: 4-(1,3-benzodioxol-5-yl)-2-(4-methylanilino)-5-oxoindeno[1,2-b]pyridine-3-carbonitrile Traditional Name: 4-(1,3-benzodioxol-5-yl)-5-keto-2-(p-toluidino)indeno[1,2-b]pyridine-3-carbonitrile Formula: C27H17N3O3 MolecularWeight: 431.44218

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC2=NC3=C(C(=C2C#N)C4=CC5=C(C=C4)OCO5)C(=O)C6=CC=CC=C63

Isomeric SMILES

CC1=CC=C(C=C1)NC2=NC3=C(C(=C2C#N)C4=CC5=C(C=C4)OCO5)C(=O)C6=CC=CC=C63

InChI

InChI=1S/C27H17N3O3/c1-15-6-9-17(10-7-15)29-27-20(13-28)23(16-8-11-21-22(12-16)33-14-32-21)24-25(30-27)18-4-2-3-5-19(18)26(24)31/h2-12H,14H2,1H3,(H,29,30)