4-(2-chlorophenyl)-2-(4-nitrophenyl)-2,3-dihydro-1,5-benzothiazepine

Systemtic Name: 4-(2-chlorophenyl)-2-(4-nitrophenyl)-2,3-dihydro-1,5-benzothiazepine Openeye Name: 4-(2-chlorophenyl)-2-(4-nitrophenyl)-2,3-dihydro-1,5-benzothiazepine CAS Name: 4-(2-chlorophenyl)-2-(4-nitrophenyl)-2,3-dihydro-1,5-benzothiazepine IUPAC Name: 4-(2-chlorophenyl)-2-(4-nitrophenyl)-2,3-dihydro-1,5-benzothiazepine Traditional Name: 4-(2-chlorophenyl)-2-(4-nitrophenyl)-2,3-dihydro-1,5-benzothiazepine Formula: C21H15ClN2O2S MolecularWeight: 394.874

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Descriptors Computed from Structure

Canonical SMILES:

C1C(SC2=CC=CC=C2N=C1C3=CC=CC=C3Cl)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1C(SC2=CC=CC=C2N=C1C3=CC=CC=C3Cl)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H15ClN2O2S/c22-17-6-2-1-5-16(17)19-13-21(14-9-11-15(12-10-14)24(25)26)27-20-8-4-3-7-18(20)23-19/h1-12,21H,13H2