2-[4-(3,5-dimethoxyphenyl)carbonylpiperazin-1-yl]-7-methyl-quinoline-3-carbonitrile

Systemtic Name: 2-[4-(3,5-dimethoxyphenyl)carbonylpiperazin-1-yl]-7-methyl-quinoline-3-carbonitrile Openeye Name: 2-[4-(3,5-dimethoxybenzoyl)piperazin-1-yl]-7-methyl-quinoline-3-carbonitrile CAS Name: 2-[4-[(3,5-dimethoxyphenyl)-oxomethyl]-1-piperazinyl]-7-methyl-3-quinolinecarbonitrile IUPAC Name: 2-[4-(3,5-dimethoxybenzoyl)piperazin-1-yl]-7-methylquinoline-3-carbonitrile Traditional Name: 2-[4-(3,5-dimethoxybenzoyl)piperazino]-7-methyl-quinoline-3-carbonitrile Formula: C24H24N4O3 MolecularWeight: 416.47236

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C=C(C(=N2)N3CCN(CC3)C(=O)C4=CC(=CC(=C4)OC)OC)C#N

Isomeric SMILES

CC1=CC2=C(C=C1)C=C(C(=N2)N3CCN(CC3)C(=O)C4=CC(=CC(=C4)OC)OC)C#N

InChI

InChI=1S/C24H24N4O3/c1-16-4-5-17-11-19(15-25)23(26-22(17)10-16)27-6-8-28(9-7-27)24(29)18-12-20(30-2)14-21(13-18)31-3/h4-5,10-14H,6-9H2,1-3H3