2-[4-(3,5-dimethoxyphenyl)carbonylpiperazin-1-yl]-6,7-dimethyl-quinoline-3-carbonitrile

Systemtic Name: 2-[4-(3,5-dimethoxyphenyl)carbonylpiperazin-1-yl]-6,7-dimethyl-quinoline-3-carbonitrile Openeye Name: 2-[4-(3,5-dimethoxybenzoyl)piperazin-1-yl]-6,7-dimethyl-quinoline-3-carbonitrile CAS Name: 2-[4-[(3,5-dimethoxyphenyl)-oxomethyl]-1-piperazinyl]-6,7-dimethyl-3-quinolinecarbonitrile IUPAC Name: 2-[4-(3,5-dimethoxybenzoyl)piperazin-1-yl]-6,7-dimethylquinoline-3-carbonitrile Traditional Name: 2-[4-(3,5-dimethoxybenzoyl)piperazino]-6,7-dimethyl-quinoline-3-carbonitrile Formula: C25H26N4O3 MolecularWeight: 430.49894

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C=C(C(=N2)N3CCN(CC3)C(=O)C4=CC(=CC(=C4)OC)OC)C#N)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C=C(C(=N2)N3CCN(CC3)C(=O)C4=CC(=CC(=C4)OC)OC)C#N)C

InChI

InChI=1S/C25H26N4O3/c1-16-9-18-11-20(15-26)24(27-23(18)10-17(16)2)28-5-7-29(8-6-28)25(30)19-12-21(31-3)14-22(13-19)32-4/h9-14H,5-8H2,1-4H3