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

Systemtic Name: 7-(4-methylphenyl)-N-(2-piperidin-4-ylethyl)-2,3-dihydro-1-benzoxepine-4-carboxamide Openeye Name: N-[2-(4-piperidyl)ethyl]-7-(p-tolyl)-2,3-dihydro-1-benzoxepine-4-carboxamide CAS Name: 7-(4-methylphenyl)-N-[2-(4-piperidinyl)ethyl]-2,3-dihydro-1-benzoxepin-4-carboxamide IUPAC Name: 7-(4-methylphenyl)-N-(2-piperidin-4-ylethyl)-2,3-dihydro-1-benzoxepine-4-carboxamide Traditional Name: N-[2-(4-piperidyl)ethyl]-7-(p-tolyl)-2,3-dihydro-1-benzoxepin-4-carboxamide Formula: C25H30N2O2 MolecularWeight: 390.5179

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC3=C(C=C2)OCCC(=C3)C(=O)NCCC4CCNCC4

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC3=C(C=C2)OCCC(=C3)C(=O)NCCC4CCNCC4

InChI

InChI=1S/C25H30N2O2/c1-18-2-4-20(5-3-18)21-6-7-24-23(16-21)17-22(11-15-29-24)25(28)27-14-10-19-8-12-26-13-9-19/h2-7,16-17,19,26H,8-15H2,1H3,(H,27,28)