4-[(3-methoxyphenyl)methyl]-7-(2-methylphenyl)-9-(oxolan-3-yloxy)-3,5-dihydro-2H-1,4-benzoxazepine

Systemtic Name: 4-[(3-methoxyphenyl)methyl]-7-(2-methylphenyl)-9-(oxolan-3-yloxy)-3,5-dihydro-2H-1,4-benzoxazepine Openeye Name: 4-[(3-methoxyphenyl)methyl]-7-(o-tolyl)-9-tetrahydrofuran-3-yloxy-3,5-dihydro-2H-1,4-benzoxazepine CAS Name: 4-[(3-methoxyphenyl)methyl]-7-(2-methylphenyl)-9-(3-oxolanyloxy)-3,5-dihydro-2H-1,4-benzoxazepine IUPAC Name: 4-[(3-methoxyphenyl)methyl]-7-(2-methylphenyl)-9-(oxolan-3-yloxy)-3,5-dihydro-2H-1,4-benzoxazepine Traditional Name: 4-m-anisyl-7-(o-tolyl)-9-tetrahydrofuran-3-yloxy-3,5-dihydro-2H-1,4-benzoxazepine Formula: C28H31NO4 MolecularWeight: 445.55004

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=CC3=C(C(=C2)OC4CCOC4)OCCN(C3)CC5=CC(=CC=C5)OC

Isomeric SMILES

CC1=CC=CC=C1C2=CC3=C(C(=C2)OC4CCOC4)OCCN(C3)CC5=CC(=CC=C5)OC

InChI

InChI=1S/C28H31NO4/c1-20-6-3-4-9-26(20)22-15-23-18-29(17-21-7-5-8-24(14-21)30-2)11-13-32-28(23)27(16-22)33-25-10-12-31-19-25/h3-9,14-16,25H,10-13,17-19H2,1-2H3