4-(4-methylphenyl)-3-phenyl-4,5-dihydro-3H-1,2$l^{6},5-benzoxathiazepine 2,2-dioxide

Systemtic Name: 4-(4-methylphenyl)-3-phenyl-4,5-dihydro-3H-1,2$l^{6},5-benzoxathiazepine 2,2-dioxide Openeye Name: 3-phenyl-4-(p-tolyl)-4,5-dihydro-3H-1,2$l^{6},5-benzoxathiazepine 2,2-dioxide CAS Name: 4-(4-methylphenyl)-3-phenyl-4,5-dihydro-3H-1,2$l^{6},5-benzoxathiazepine 2,2-dioxide IUPAC Name: 4-(4-methylphenyl)-3-phenyl-4,5-dihydro-3H-1,2$l^{6},5-benzoxathiazepine 2,2-dioxide Traditional Name: 3-phenyl-4-(p-tolyl)-4,5-dihydro-3H-1,2$l^{6},5-benzoxathiazepine 2,2-dioxide Formula: C21H19NO3S MolecularWeight: 365.44546

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2C(S(=O)(=O)OC3=CC=CC=C3N2)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)C2C(S(=O)(=O)OC3=CC=CC=C3N2)C4=CC=CC=C4

InChI

InChI=1S/C21H19NO3S/c1-15-11-13-16(14-12-15)20-21(17-7-3-2-4-8-17)26(23,24)25-19-10-6-5-9-18(19)22-20/h2-14,20-22H,1H3