4-(2-chlorophenyl)sulfonyl-9-[2-(1-methylpyrrolidin-2-yl)ethoxy]-7-pyridin-3-yl-3,5-dihydro-2H-1,4-benzoxazepine

Systemtic Name: 4-(2-chlorophenyl)sulfonyl-9-[2-(1-methylpyrrolidin-2-yl)ethoxy]-7-pyridin-3-yl-3,5-dihydro-2H-1,4-benzoxazepine Openeye Name: 4-(2-chlorophenyl)sulfonyl-9-[2-(1-methylpyrrolidin-2-yl)ethoxy]-7-(3-pyridyl)-3,5-dihydro-2H-1,4-benzoxazepine CAS Name: 4-(2-chlorophenyl)sulfonyl-9-[2-(1-methyl-2-pyrrolidinyl)ethoxy]-7-(3-pyridinyl)-3,5-dihydro-2H-1,4-benzoxazepine IUPAC Name: 4-(2-chlorophenyl)sulfonyl-9-[2-(1-methylpyrrolidin-2-yl)ethoxy]-7-pyridin-3-yl-3,5-dihydro-2H-1,4-benzoxazepine Traditional Name: 4-(2-chlorophenyl)sulfonyl-9-[2-(1-methylpyrrolidin-2-yl)ethoxy]-7-(3-pyridyl)-3,5-dihydro-2H-1,4-benzoxazepine Formula: C27H30ClN3O4S MolecularWeight: 528.0628

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCCC1CCOC2=CC(=CC3=C2OCCN(C3)S(=O)(=O)C4=CC=CC=C4Cl)C5=CN=CC=C5

Isomeric SMILES

CN1CCCC1CCOC2=CC(=CC3=C2OCCN(C3)S(=O)(=O)C4=CC=CC=C4Cl)C5=CN=CC=C5

InChI

InChI=1S/C27H30ClN3O4S/c1-30-12-5-7-23(30)10-14-34-25-17-21(20-6-4-11-29-18-20)16-22-19-31(13-15-35-27(22)25)36(32,33)26-9-3-2-8-24(26)28/h2-4,6,8-9,11,16-18,23H,5,7,10,12-15,19H2,1H3