2-[(2,4-dimethylphenyl)amino]-6-methoxy-7-[3-(1-methylpiperidin-4-yl)propoxy]quinoline-3-carbonitrile

Systemtic Name: 2-[(2,4-dimethylphenyl)amino]-6-methoxy-7-[3-(1-methylpiperidin-4-yl)propoxy]quinoline-3-carbonitrile Openeye Name: 2-(2,4-dimethylanilino)-6-methoxy-7-[3-(1-methyl-4-piperidyl)propoxy]quinoline-3-carbonitrile CAS Name: 2-(2,4-dimethylanilino)-6-methoxy-7-[3-(1-methyl-4-piperidinyl)propoxy]-3-quinolinecarbonitrile IUPAC Name: 2-(2,4-dimethylanilino)-6-methoxy-7-[3-(1-methylpiperidin-4-yl)propoxy]quinoline-3-carbonitrile Traditional Name: 2-(2,4-dimethylanilino)-6-methoxy-7-[3-(1-methyl-4-piperidyl)propoxy]quinoline-3-carbonitrile Formula: C28H34N4O2 MolecularWeight: 458.59516

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC2=NC3=CC(=C(C=C3C=C2C#N)OC)OCCCC4CCN(CC4)C)C

Isomeric SMILES

CC1=CC(=C(C=C1)NC2=NC3=CC(=C(C=C3C=C2C#N)OC)OCCCC4CCN(CC4)C)C

InChI

InChI=1S/C28H34N4O2/c1-19-7-8-24(20(2)14-19)30-28-23(18-29)15-22-16-26(33-4)27(17-25(22)31-28)34-13-5-6-21-9-11-32(3)12-10-21/h7-8,14-17,21H,5-6,9-13H2,1-4H3,(H,30,31)