7-(4-methylphenyl)-N-(3-piperidin-4-ylpropyl)-2,3-dihydro-1-benzoxepine-4-carboxamide

Systemtic Name: 7-(4-methylphenyl)-N-(3-piperidin-4-ylpropyl)-2,3-dihydro-1-benzoxepine-4-carboxamide Openeye Name: N-[3-(4-piperidyl)propyl]-7-(p-tolyl)-2,3-dihydro-1-benzoxepine-4-carboxamide CAS Name: 7-(4-methylphenyl)-N-[3-(4-piperidinyl)propyl]-2,3-dihydro-1-benzoxepin-4-carboxamide IUPAC Name: 7-(4-methylphenyl)-N-(3-piperidin-4-ylpropyl)-2,3-dihydro-1-benzoxepine-4-carboxamide Traditional Name: N-[3-(4-piperidyl)propyl]-7-(p-tolyl)-2,3-dihydro-1-benzoxepin-4-carboxamide Formula: C26H32N2O2 MolecularWeight: 404.54448

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC3=C(C=C2)OCCC(=C3)C(=O)NCCCC4CCNCC4

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC3=C(C=C2)OCCC(=C3)C(=O)NCCCC4CCNCC4

InChI

InChI=1S/C26H32N2O2/c1-19-4-6-21(7-5-19)22-8-9-25-24(17-22)18-23(12-16-30-25)26(29)28-13-2-3-20-10-14-27-15-11-20/h4-9,17-18,20,27H,2-3,10-16H2,1H3,(H,28,29)