[6,7-dimethoxy-4-(4-phenylpiperazin-1-yl)quinolin-3-yl]-phenyl-methanone

Systemtic Name: [6,7-dimethoxy-4-(4-phenylpiperazin-1-yl)quinolin-3-yl]-phenyl-methanone Openeye Name: [6,7-dimethoxy-4-(4-phenylpiperazin-1-yl)-3-quinolyl]-phenyl-methanone CAS Name: [6,7-dimethoxy-4-(4-phenyl-1-piperazinyl)-3-quinolinyl]-phenylmethanone IUPAC Name: [6,7-dimethoxy-4-(4-phenylpiperazin-1-yl)quinolin-3-yl]-phenylmethanone Traditional Name: [6,7-dimethoxy-4-(4-phenylpiperazino)-3-quinolyl]-phenyl-methanone Formula: C28H27N3O3 MolecularWeight: 453.53228

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=C(C=N2)C(=O)C3=CC=CC=C3)N4CCN(CC4)C5=CC=CC=C5)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=C(C=N2)C(=O)C3=CC=CC=C3)N4CCN(CC4)C5=CC=CC=C5)OC

InChI

InChI=1S/C28H27N3O3/c1-33-25-17-22-24(18-26(25)34-2)29-19-23(28(32)20-9-5-3-6-10-20)27(22)31-15-13-30(14-16-31)21-11-7-4-8-12-21/h3-12,17-19H,13-16H2,1-2H3