9-methoxy-4-(4-methoxyphenyl)sulfonyl-7-pyridin-3-yl-3,5-dihydro-2H-1,4-benzoxazepine

Systemtic Name: 9-methoxy-4-(4-methoxyphenyl)sulfonyl-7-pyridin-3-yl-3,5-dihydro-2H-1,4-benzoxazepine Openeye Name: 9-methoxy-4-(4-methoxyphenyl)sulfonyl-7-(3-pyridyl)-3,5-dihydro-2H-1,4-benzoxazepine CAS Name: 9-methoxy-4-(4-methoxyphenyl)sulfonyl-7-(3-pyridinyl)-3,5-dihydro-2H-1,4-benzoxazepine IUPAC Name: 9-methoxy-4-(4-methoxyphenyl)sulfonyl-7-pyridin-3-yl-3,5-dihydro-2H-1,4-benzoxazepine Traditional Name: 9-methoxy-4-(4-methoxyphenyl)sulfonyl-7-(3-pyridyl)-3,5-dihydro-2H-1,4-benzoxazepine Formula: C22H22N2O5S MolecularWeight: 426.48548

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)N2CCOC3=C(C2)C=C(C=C3OC)C4=CN=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)N2CCOC3=C(C2)C=C(C=C3OC)C4=CN=CC=C4

InChI

InChI=1S/C22H22N2O5S/c1-27-19-5-7-20(8-6-19)30(25,26)24-10-11-29-22-18(15-24)12-17(13-21(22)28-2)16-4-3-9-23-14-16/h3-9,12-14H,10-11,15H2,1-2H3