[2-[(2,4-dimethoxyphenyl)amino]quinolin-4-yl]-(4-phenylpiperazin-1-yl)methanone

Systemtic Name: [2-[(2,4-dimethoxyphenyl)amino]quinolin-4-yl]-(4-phenylpiperazin-1-yl)methanone Openeye Name: [2-(2,4-dimethoxyanilino)-4-quinolyl]-(4-phenylpiperazin-1-yl)methanone CAS Name: [2-(2,4-dimethoxyanilino)-4-quinolinyl]-(4-phenyl-1-piperazinyl)methanone IUPAC Name: [2-(2,4-dimethoxyanilino)quinolin-4-yl]-(4-phenylpiperazin-1-yl)methanone Traditional Name: [2-(2,4-dimethoxyanilino)-4-quinolyl]-(4-phenylpiperazino)methanone Formula: C28H28N4O3 MolecularWeight: 468.54692

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)NC2=NC3=CC=CC=C3C(=C2)C(=O)N4CCN(CC4)C5=CC=CC=C5)OC

Isomeric SMILES

COC1=CC(=C(C=C1)NC2=NC3=CC=CC=C3C(=C2)C(=O)N4CCN(CC4)C5=CC=CC=C5)OC

InChI

InChI=1S/C28H28N4O3/c1-34-21-12-13-25(26(18-21)35-2)30-27-19-23(22-10-6-7-11-24(22)29-27)28(33)32-16-14-31(15-17-32)20-8-4-3-5-9-20/h3-13,18-19H,14-17H2,1-2H3,(H,29,30)