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

Systemtic Name: N-[1-(2-cyclohexylethyl)piperidin-4-yl]-7-(4-methylphenyl)-2,3-dihydro-1-benzoxepine-4-carboxamide Openeye Name: N-[1-(2-cyclohexylethyl)-4-piperidyl]-7-(p-tolyl)-2,3-dihydro-1-benzoxepine-4-carboxamide CAS Name: N-[1-(2-cyclohexylethyl)-4-piperidinyl]-7-(4-methylphenyl)-2,3-dihydro-1-benzoxepin-4-carboxamide IUPAC Name: N-[1-(2-cyclohexylethyl)piperidin-4-yl]-7-(4-methylphenyl)-2,3-dihydro-1-benzoxepine-4-carboxamide Traditional Name: N-[1-(2-cyclohexylethyl)-4-piperidyl]-7-(p-tolyl)-2,3-dihydro-1-benzoxepin-4-carboxamide Formula: C31H40N2O2 MolecularWeight: 472.6615

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC3=C(C=C2)OCCC(=C3)C(=O)NC4CCN(CC4)CCC5CCCCC5

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC3=C(C=C2)OCCC(=C3)C(=O)NC4CCN(CC4)CCC5CCCCC5

InChI

InChI=1S/C31H40N2O2/c1-23-7-9-25(10-8-23)26-11-12-30-28(21-26)22-27(16-20-35-30)31(34)32-29-14-18-33(19-15-29)17-13-24-5-3-2-4-6-24/h7-12,21-22,24,29H,2-6,13-20H2,1H3,(H,32,34)