[4-[3-[[methyl(phenethyl)amino]methyl]phenoxy]piperidin-1-yl]-quinolin-2-yl-methanone

Systemtic Name: [4-[3-[[methyl(phenethyl)amino]methyl]phenoxy]piperidin-1-yl]-quinolin-2-yl-methanone Openeye Name: [4-[3-[[methyl(phenethyl)amino]methyl]phenoxy]-1-piperidyl]-(2-quinolyl)methanone CAS Name: [4-[3-[[methyl(phenethyl)amino]methyl]phenoxy]-1-piperidinyl]-(2-quinolinyl)methanone IUPAC Name: [4-[3-[[methyl(phenethyl)amino]methyl]phenoxy]piperidin-1-yl]-quinolin-2-ylmethanone Traditional Name: [4-[3-[[methyl(phenethyl)amino]methyl]phenoxy]piperidino]-(2-quinolyl)methanone Formula: C31H33N3O2 MolecularWeight: 479.61262

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC1=CC=CC=C1)CC2=CC(=CC=C2)OC3CCN(CC3)C(=O)C4=NC5=CC=CC=C5C=C4

Isomeric SMILES

CN(CCC1=CC=CC=C1)CC2=CC(=CC=C2)OC3CCN(CC3)C(=O)C4=NC5=CC=CC=C5C=C4

InChI

InChI=1S/C31H33N3O2/c1-33(19-16-24-8-3-2-4-9-24)23-25-10-7-12-28(22-25)36-27-17-20-34(21-18-27)31(35)30-15-14-26-11-5-6-13-29(26)32-30/h2-15,22,27H,16-21,23H2,1H3