5-[2-(3-methoxypyrrolidin-1-yl)-3-(2-methylpropoxy)propyl]-4-phenyl-3,4-dihydro-2H-1,5-benzoxazepine

Systemtic Name: 5-[2-(3-methoxypyrrolidin-1-yl)-3-(2-methylpropoxy)propyl]-4-phenyl-3,4-dihydro-2H-1,5-benzoxazepine Openeye Name: 5-[3-isobutoxy-2-(3-methoxypyrrolidin-1-yl)propyl]-4-phenyl-3,4-dihydro-2H-1,5-benzoxazepine CAS Name: 5-[2-(3-methoxy-1-pyrrolidinyl)-3-(2-methylpropoxy)propyl]-4-phenyl-3,4-dihydro-2H-1,5-benzoxazepine IUPAC Name: 5-[2-(3-methoxypyrrolidin-1-yl)-3-(2-methylpropoxy)propyl]-4-phenyl-3,4-dihydro-2H-1,5-benzoxazepine Traditional Name: 5-[3-isobutoxy-2-(3-methoxypyrrolidino)propyl]-4-phenyl-3,4-dihydro-2H-1,5-benzoxazepine Formula: C27H38N2O3 MolecularWeight: 438.60222

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)COCC(CN1C(CCOC2=CC=CC=C21)C3=CC=CC=C3)N4CCC(C4)OC

Isomeric SMILES

CC(C)COCC(CN1C(CCOC2=CC=CC=C21)C3=CC=CC=C3)N4CCC(C4)OC

InChI

InChI=1S/C27H38N2O3/c1-21(2)19-31-20-23(28-15-13-24(18-28)30-3)17-29-25(22-9-5-4-6-10-22)14-16-32-27-12-8-7-11-26(27)29/h4-12,21,23-25H,13-20H2,1-3H3