7-chloranyl-3-[(4-methoxyphenyl)methyl]-4-(4-methylphenyl)sulfonyl-2,3-dihydro-1,4-benzoxazepin-5-one

Systemtic Name: 7-chloranyl-3-[(4-methoxyphenyl)methyl]-4-(4-methylphenyl)sulfonyl-2,3-dihydro-1,4-benzoxazepin-5-one Openeye Name: 7-chloro-3-[(4-methoxyphenyl)methyl]-4-(p-tolylsulfonyl)-2,3-dihydro-1,4-benzoxazepin-5-one CAS Name: 7-chloro-3-[(4-methoxyphenyl)methyl]-4-(4-methylphenyl)sulfonyl-2,3-dihydro-1,4-benzoxazepin-5-one IUPAC Name: 7-chloro-3-[(4-methoxyphenyl)methyl]-4-(4-methylphenyl)sulfonyl-2,3-dihydro-1,4-benzoxazepin-5-one Traditional Name: 7-chloro-3-p-anisyl-4-tosyl-2,3-dihydro-1,4-benzoxazepin-5-one Formula: C24H22ClNO5S MolecularWeight: 471.95318

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C(COC3=C(C2=O)C=C(C=C3)Cl)CC4=CC=C(C=C4)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2C(COC3=C(C2=O)C=C(C=C3)Cl)CC4=CC=C(C=C4)OC

InChI

InChI=1S/C24H22ClNO5S/c1-16-3-10-21(11-4-16)32(28,29)26-19(13-17-5-8-20(30-2)9-6-17)15-31-23-12-7-18(25)14-22(23)24(26)27/h3-12,14,19H,13,15H2,1-2H3