4-(2-methylpropyl)-7-[(4-phenylmethoxypiperidin-1-yl)methyl]-3,5-dihydro-2H-1,4-benzoxazepine

Systemtic Name: 4-(2-methylpropyl)-7-[(4-phenylmethoxypiperidin-1-yl)methyl]-3,5-dihydro-2H-1,4-benzoxazepine Openeye Name: 7-[(4-benzyloxy-1-piperidyl)methyl]-4-isobutyl-3,5-dihydro-2H-1,4-benzoxazepine CAS Name: 4-(2-methylpropyl)-7-[(4-phenylmethoxy-1-piperidinyl)methyl]-3,5-dihydro-2H-1,4-benzoxazepine IUPAC Name: 4-(2-methylpropyl)-7-[(4-phenylmethoxypiperidin-1-yl)methyl]-3,5-dihydro-2H-1,4-benzoxazepine Traditional Name: 7-[(4-benzoxypiperidino)methyl]-4-isobutyl-3,5-dihydro-2H-1,4-benzoxazepine Formula: C26H36N2O2 MolecularWeight: 408.57624

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1CCOC2=C(C1)C=C(C=C2)CN3CCC(CC3)OCC4=CC=CC=C4

Isomeric SMILES

CC(C)CN1CCOC2=C(C1)C=C(C=C2)CN3CCC(CC3)OCC4=CC=CC=C4

InChI

InChI=1S/C26H36N2O2/c1-21(2)17-28-14-15-29-26-9-8-23(16-24(26)19-28)18-27-12-10-25(11-13-27)30-20-22-6-4-3-5-7-22/h3-9,16,21,25H,10-15,17-20H2,1-2H3