2-[4-(3,4-dimethoxyphenyl)carbonylpiperazin-1-yl]-7,8-dimethyl-quinoline-3-carbonitrile

Systemtic Name: 2-[4-(3,4-dimethoxyphenyl)carbonylpiperazin-1-yl]-7,8-dimethyl-quinoline-3-carbonitrile Openeye Name: 2-[4-(3,4-dimethoxybenzoyl)piperazin-1-yl]-7,8-dimethyl-quinoline-3-carbonitrile CAS Name: 2-[4-[(3,4-dimethoxyphenyl)-oxomethyl]-1-piperazinyl]-7,8-dimethyl-3-quinolinecarbonitrile IUPAC Name: 2-[4-(3,4-dimethoxybenzoyl)piperazin-1-yl]-7,8-dimethylquinoline-3-carbonitrile Traditional Name: 7,8-dimethyl-2-(4-veratroylpiperazino)quinoline-3-carbonitrile Formula: C25H26N4O3 MolecularWeight: 430.49894

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)C=C(C(=N2)N3CCN(CC3)C(=O)C4=CC(=C(C=C4)OC)OC)C#N)C

Isomeric SMILES

CC1=C(C2=C(C=C1)C=C(C(=N2)N3CCN(CC3)C(=O)C4=CC(=C(C=C4)OC)OC)C#N)C

InChI

InChI=1S/C25H26N4O3/c1-16-5-6-18-13-20(15-26)24(27-23(18)17(16)2)28-9-11-29(12-10-28)25(30)19-7-8-21(31-3)22(14-19)32-4/h5-8,13-14H,9-12H2,1-4H3