2-methyl-4-(4-nitrophenyl)-2,3-dihydro-1$l^{4},5-benzothiazepine 1-oxide

Systemtic Name: 2-methyl-4-(4-nitrophenyl)-2,3-dihydro-1$l^{4},5-benzothiazepine 1-oxide Openeye Name: 2-methyl-4-(4-nitrophenyl)-2,3-dihydro-1$l^{4},5-benzothiazepine 1-oxide CAS Name: 2-methyl-4-(4-nitrophenyl)-2,3-dihydro-1$l^{4},5-benzothiazepine 1-oxide IUPAC Name: 2-methyl-4-(4-nitrophenyl)-2,3-dihydro-1$l^{4},5-benzothiazepine 1-oxide Traditional Name: 2-methyl-4-(4-nitrophenyl)-2,3-dihydro-1$l^{4},5-benzothiazepine 1-oxide Formula: C16H14N2O3S MolecularWeight: 314.35896

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(=NC2=CC=CC=C2S1=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1CC(=NC2=CC=CC=C2S1=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H14N2O3S/c1-11-10-15(12-6-8-13(9-7-12)18(19)20)17-14-4-2-3-5-16(14)22(11)21/h2-9,11H,10H2,1H3