11-[[1-(2-methyl-2-phenyl-propyl)pyrrolidin-2-yl]methyl]-6H-benzo[c][1,5]benzoxazepine

Systemtic Name: 11-[[1-(2-methyl-2-phenyl-propyl)pyrrolidin-2-yl]methyl]-6H-benzo[c][1,5]benzoxazepine Openeye Name: 11-[[1-(2-methyl-2-phenyl-propyl)pyrrolidin-2-yl]methyl]-6H-benzo[c][1,5]benzoxazepine CAS Name: 11-[[1-(2-methyl-2-phenylpropyl)-2-pyrrolidinyl]methyl]-6H-benzo[c][1,5]benzoxazepine IUPAC Name: 11-[[1-(2-methyl-2-phenylpropyl)pyrrolidin-2-yl]methyl]-6H-benzo[c][1,5]benzoxazepine Traditional Name: 11-[(1-neophylpyrrolidin-2-yl)methyl]-6H-benzo[c][1,5]benzoxazepine Formula: C28H32N2O MolecularWeight: 412.56648

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CN1CCCC1CN2C3=CC=CC=C3COC4=CC=CC=C42)C5=CC=CC=C5

Isomeric SMILES

CC(C)(CN1CCCC1CN2C3=CC=CC=C3COC4=CC=CC=C42)C5=CC=CC=C5

InChI

InChI=1S/C28H32N2O/c1-28(2,23-12-4-3-5-13-23)21-29-18-10-14-24(29)19-30-25-15-7-6-11-22(25)20-31-27-17-9-8-16-26(27)30/h3-9,11-13,15-17,24H,10,14,18-21H2,1-2H3