N-methyl-7-(4-methylphenyl)-N-[1-(oxan-4-yl)piperidin-4-yl]-2,3-dihydro-1-benzoxepine-4-carboxamide

Systemtic Name: N-methyl-7-(4-methylphenyl)-N-[1-(oxan-4-yl)piperidin-4-yl]-2,3-dihydro-1-benzoxepine-4-carboxamide Openeye Name: N-methyl-7-(p-tolyl)-N-(1-tetrahydropyran-4-yl-4-piperidyl)-2,3-dihydro-1-benzoxepine-4-carboxamide CAS Name: N-methyl-7-(4-methylphenyl)-N-[1-(4-oxanyl)-4-piperidinyl]-2,3-dihydro-1-benzoxepin-4-carboxamide IUPAC Name: N-methyl-7-(4-methylphenyl)-N-[1-(oxan-4-yl)piperidin-4-yl]-2,3-dihydro-1-benzoxepine-4-carboxamide Traditional Name: N-methyl-7-(p-tolyl)-N-(1-tetrahydropyran-4-yl-4-piperidyl)-2,3-dihydro-1-benzoxepin-4-carboxamide Formula: C29H36N2O3 MolecularWeight: 460.60774

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC3=C(C=C2)OCCC(=C3)C(=O)N(C)C4CCN(CC4)C5CCOCC5

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC3=C(C=C2)OCCC(=C3)C(=O)N(C)C4CCN(CC4)C5CCOCC5

InChI

InChI=1S/C29H36N2O3/c1-21-3-5-22(6-4-21)23-7-8-28-25(19-23)20-24(11-18-34-28)29(32)30(2)26-9-14-31(15-10-26)27-12-16-33-17-13-27/h3-8,19-20,26-27H,9-18H2,1-2H3