1-[4-[2-(4-methoxyphenyl)quinolin-4-yl]carbonylpiperazin-1-yl]-2-methyl-propan-1-one

Systemtic Name: 1-[4-[2-(4-methoxyphenyl)quinolin-4-yl]carbonylpiperazin-1-yl]-2-methyl-propan-1-one Openeye Name: 1-[4-[2-(4-methoxyphenyl)quinoline-4-carbonyl]piperazin-1-yl]-2-methyl-propan-1-one CAS Name: 1-[4-[[2-(4-methoxyphenyl)-4-quinolinyl]-oxomethyl]-1-piperazinyl]-2-methyl-1-propanone IUPAC Name: 1-[4-[2-(4-methoxyphenyl)quinoline-4-carbonyl]piperazin-1-yl]-2-methylpropan-1-one Traditional Name: 1-[4-[2-(4-methoxyphenyl)quinoline-4-carbonyl]piperazino]-2-methyl-propan-1-one Formula: C25H27N3O3 MolecularWeight: 417.50018

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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

Isomeric SMILES

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

InChI

InChI=1S/C25H27N3O3/c1-17(2)24(29)27-12-14-28(15-13-27)25(30)21-16-23(18-8-10-19(31-3)11-9-18)26-22-7-5-4-6-20(21)22/h4-11,16-17H,12-15H2,1-3H3