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

Systemtic Name: 4-(2-chlorophenyl)sulfonyl-7-(2-methylphenyl)-9-(oxolan-3-ylmethoxy)-3,5-dihydro-2H-1,4-benzoxazepine Openeye Name: 4-(2-chlorophenyl)sulfonyl-7-(o-tolyl)-9-(tetrahydrofuran-3-ylmethoxy)-3,5-dihydro-2H-1,4-benzoxazepine CAS Name: 4-(2-chlorophenyl)sulfonyl-7-(2-methylphenyl)-9-(3-oxolanylmethoxy)-3,5-dihydro-2H-1,4-benzoxazepine IUPAC Name: 4-(2-chlorophenyl)sulfonyl-7-(2-methylphenyl)-9-(oxolan-3-ylmethoxy)-3,5-dihydro-2H-1,4-benzoxazepine Traditional Name: 4-(2-chlorophenyl)sulfonyl-7-(o-tolyl)-9-(tetrahydrofuran-3-ylmethoxy)-3,5-dihydro-2H-1,4-benzoxazepine Formula: C27H28ClNO5S MolecularWeight: 514.03292

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=CC3=C(C(=C2)OCC4CCOC4)OCCN(C3)S(=O)(=O)C5=CC=CC=C5Cl

Isomeric SMILES

CC1=CC=CC=C1C2=CC3=C(C(=C2)OCC4CCOC4)OCCN(C3)S(=O)(=O)C5=CC=CC=C5Cl

InChI

InChI=1S/C27H28ClNO5S/c1-19-6-2-3-7-23(19)21-14-22-16-29(35(30,31)26-9-5-4-8-24(26)28)11-13-33-27(22)25(15-21)34-18-20-10-12-32-17-20/h2-9,14-15,20H,10-13,16-18H2,1H3