N'-[2-(3,5-dimethylpiperidin-1-yl)-4-methyl-quinolin-6-yl]-N-(4-phenoxyphenyl)butanediamide

Systemtic Name: N'-[2-(3,5-dimethylpiperidin-1-yl)-4-methyl-quinolin-6-yl]-N-(4-phenoxyphenyl)butanediamide Openeye Name: N'-[2-(3,5-dimethyl-1-piperidyl)-4-methyl-6-quinolyl]-N-(4-phenoxyphenyl)butanediamide CAS Name: N'-[2-(3,5-dimethyl-1-piperidinyl)-4-methyl-6-quinolinyl]-N-(4-phenoxyphenyl)butanediamide IUPAC Name: N'-[2-(3,5-dimethylpiperidin-1-yl)-4-methylquinolin-6-yl]-N-(4-phenoxyphenyl)butanediamide Traditional Name: N'-[2-(3,5-dimethylpiperidino)-4-methyl-6-quinolyl]-N-(4-phenoxyphenyl)succinamide Formula: C33H36N4O3 MolecularWeight: 536.66394

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)C2=NC3=C(C=C(C=C3)NC(=O)CCC(=O)NC4=CC=C(C=C4)OC5=CC=CC=C5)C(=C2)C)C

Isomeric SMILES

CC1CC(CN(C1)C2=NC3=C(C=C(C=C3)NC(=O)CCC(=O)NC4=CC=C(C=C4)OC5=CC=CC=C5)C(=C2)C)C

InChI

InChI=1S/C33H36N4O3/c1-22-17-23(2)21-37(20-22)31-18-24(3)29-19-26(11-14-30(29)36-31)35-33(39)16-15-32(38)34-25-9-12-28(13-10-25)40-27-7-5-4-6-8-27/h4-14,18-19,22-23H,15-17,20-21H2,1-3H3,(H,34,38)(H,35,39)