1-[4-[2-(3,4-dimethoxyphenyl)quinolin-4-yl]carbonylpiperazin-1-yl]-2-methyl-propan-1-one

Systemtic Name: 1-[4-[2-(3,4-dimethoxyphenyl)quinolin-4-yl]carbonylpiperazin-1-yl]-2-methyl-propan-1-one Openeye Name: 1-[4-[2-(3,4-dimethoxyphenyl)quinoline-4-carbonyl]piperazin-1-yl]-2-methyl-propan-1-one CAS Name: 1-[4-[[2-(3,4-dimethoxyphenyl)-4-quinolinyl]-oxomethyl]-1-piperazinyl]-2-methyl-1-propanone IUPAC Name: 1-[4-[2-(3,4-dimethoxyphenyl)quinoline-4-carbonyl]piperazin-1-yl]-2-methylpropan-1-one Traditional Name: 1-[4-[2-(3,4-dimethoxyphenyl)quinoline-4-carbonyl]piperazino]-2-methyl-propan-1-one Formula: C26H29N3O4 MolecularWeight: 447.52616

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)N1CCN(CC1)C(=O)C2=CC(=NC3=CC=CC=C32)C4=CC(=C(C=C4)OC)OC

Isomeric SMILES

CC(C)C(=O)N1CCN(CC1)C(=O)C2=CC(=NC3=CC=CC=C32)C4=CC(=C(C=C4)OC)OC

InChI

InChI=1S/C26H29N3O4/c1-17(2)25(30)28-11-13-29(14-12-28)26(31)20-16-22(27-21-8-6-5-7-19(20)21)18-9-10-23(32-3)24(15-18)33-4/h5-10,15-17H,11-14H2,1-4H3