7-(2-methylphenyl)-9-(oxolan-3-ylmethoxy)-4-(1-propylpiperidin-4-yl)-3,5-dihydro-2H-1,4-benzoxazepine

Systemtic Name: 7-(2-methylphenyl)-9-(oxolan-3-ylmethoxy)-4-(1-propylpiperidin-4-yl)-3,5-dihydro-2H-1,4-benzoxazepine Openeye Name: 7-(o-tolyl)-4-(1-propyl-4-piperidyl)-9-(tetrahydrofuran-3-ylmethoxy)-3,5-dihydro-2H-1,4-benzoxazepine CAS Name: 7-(2-methylphenyl)-9-(3-oxolanylmethoxy)-4-(1-propyl-4-piperidinyl)-3,5-dihydro-2H-1,4-benzoxazepine IUPAC Name: 7-(2-methylphenyl)-9-(oxolan-3-ylmethoxy)-4-(1-propylpiperidin-4-yl)-3,5-dihydro-2H-1,4-benzoxazepine Traditional Name: 7-(o-tolyl)-4-(1-propyl-4-piperidyl)-9-(tetrahydrofuran-3-ylmethoxy)-3,5-dihydro-2H-1,4-benzoxazepine Formula: C29H40N2O3 MolecularWeight: 464.6395

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1CCC(CC1)N2CCOC3=C(C2)C=C(C=C3OCC4CCOC4)C5=CC=CC=C5C

Isomeric SMILES

CCCN1CCC(CC1)N2CCOC3=C(C2)C=C(C=C3OCC4CCOC4)C5=CC=CC=C5C

InChI

InChI=1S/C29H40N2O3/c1-3-11-30-12-8-26(9-13-30)31-14-16-33-29-25(19-31)17-24(27-7-5-4-6-22(27)2)18-28(29)34-21-23-10-15-32-20-23/h4-7,17-18,23,26H,3,8-16,19-21H2,1-2H3