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

Systemtic Name: N-cyclohexyl-7-(4-methylphenyl)-N-[[methyl(piperidin-4-yl)amino]methyl]-2,3-dihydro-1-benzoxepine-4-carboxamide Openeye Name: N-cyclohexyl-N-[[methyl(4-piperidyl)amino]methyl]-7-(p-tolyl)-2,3-dihydro-1-benzoxepine-4-carboxamide CAS Name: N-cyclohexyl-7-(4-methylphenyl)-N-[[methyl(4-piperidinyl)amino]methyl]-2,3-dihydro-1-benzoxepin-4-carboxamide IUPAC Name: N-cyclohexyl-7-(4-methylphenyl)-N-[[methyl(piperidin-4-yl)amino]methyl]-2,3-dihydro-1-benzoxepine-4-carboxamide Traditional Name: N-cyclohexyl-N-[[methyl(4-piperidyl)amino]methyl]-7-(p-tolyl)-2,3-dihydro-1-benzoxepin-4-carboxamide Formula: C31H41N3O2 MolecularWeight: 487.67614

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC3=C(C=C2)OCCC(=C3)C(=O)N(CN(C)C4CCNCC4)C5CCCCC5

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC3=C(C=C2)OCCC(=C3)C(=O)N(CN(C)C4CCNCC4)C5CCCCC5

InChI

InChI=1S/C31H41N3O2/c1-23-8-10-24(11-9-23)25-12-13-30-27(20-25)21-26(16-19-36-30)31(35)34(29-6-4-3-5-7-29)22-33(2)28-14-17-32-18-15-28/h8-13,20-21,28-29,32H,3-7,14-19,22H2,1-2H3