[4-[2-(3,4-dimethoxyphenyl)quinolin-4-yl]carbonylpiperazin-1-yl]-phenyl-methanone

Systemtic Name: [4-[2-(3,4-dimethoxyphenyl)quinolin-4-yl]carbonylpiperazin-1-yl]-phenyl-methanone Openeye Name: [4-[2-(3,4-dimethoxyphenyl)quinoline-4-carbonyl]piperazin-1-yl]-phenyl-methanone CAS Name: [4-[[2-(3,4-dimethoxyphenyl)-4-quinolinyl]-oxomethyl]-1-piperazinyl]-phenylmethanone IUPAC Name: [4-[2-(3,4-dimethoxyphenyl)quinoline-4-carbonyl]piperazin-1-yl]-phenylmethanone Traditional Name: [4-[2-(3,4-dimethoxyphenyl)quinoline-4-carbonyl]piperazino]-phenyl-methanone Formula: C29H27N3O4 MolecularWeight: 481.54238

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)N4CCN(CC4)C(=O)C5=CC=CC=C5)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)N4CCN(CC4)C(=O)C5=CC=CC=C5)OC

InChI

InChI=1S/C29H27N3O4/c1-35-26-13-12-21(18-27(26)36-2)25-19-23(22-10-6-7-11-24(22)30-25)29(34)32-16-14-31(15-17-32)28(33)20-8-4-3-5-9-20/h3-13,18-19H,14-17H2,1-2H3