[2-(2,5-dimethoxyphenyl)-6-methyl-quinolin-4-yl]-(4-phenethylpiperazin-1-yl)methanone

Systemtic Name: [2-(2,5-dimethoxyphenyl)-6-methyl-quinolin-4-yl]-(4-phenethylpiperazin-1-yl)methanone Openeye Name: [2-(2,5-dimethoxyphenyl)-6-methyl-4-quinolyl]-(4-phenethylpiperazin-1-yl)methanone CAS Name: [2-(2,5-dimethoxyphenyl)-6-methyl-4-quinolinyl]-(4-phenethyl-1-piperazinyl)methanone IUPAC Name: [2-(2,5-dimethoxyphenyl)-6-methylquinolin-4-yl]-(4-phenethylpiperazin-1-yl)methanone Traditional Name: [2-(2,5-dimethoxyphenyl)-6-methyl-4-quinolyl]-(4-phenethylpiperazino)methanone Formula: C31H33N3O3 MolecularWeight: 495.61202

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(C=C2C(=O)N3CCN(CC3)CCC4=CC=CC=C4)C5=C(C=CC(=C5)OC)OC

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(C=C2C(=O)N3CCN(CC3)CCC4=CC=CC=C4)C5=C(C=CC(=C5)OC)OC

InChI

InChI=1S/C31H33N3O3/c1-22-9-11-28-25(19-22)26(21-29(32-28)27-20-24(36-2)10-12-30(27)37-3)31(35)34-17-15-33(16-18-34)14-13-23-7-5-4-6-8-23/h4-12,19-21H,13-18H2,1-3H3