9-chloranyl-4-(2,4-dichlorophenyl)-2-(4-nitrophenyl)-2,3-dihydro-1,5-benzothiazepine

Systemtic Name: 9-chloranyl-4-(2,4-dichlorophenyl)-2-(4-nitrophenyl)-2,3-dihydro-1,5-benzothiazepine Openeye Name: 9-chloro-4-(2,4-dichlorophenyl)-2-(4-nitrophenyl)-2,3-dihydro-1,5-benzothiazepine CAS Name: 9-chloro-4-(2,4-dichlorophenyl)-2-(4-nitrophenyl)-2,3-dihydro-1,5-benzothiazepine IUPAC Name: 9-chloro-4-(2,4-dichlorophenyl)-2-(4-nitrophenyl)-2,3-dihydro-1,5-benzothiazepine Traditional Name: 9-chloro-4-(2,4-dichlorophenyl)-2-(4-nitrophenyl)-2,3-dihydro-1,5-benzothiazepine Formula: C21H13Cl3N2O2S MolecularWeight: 463.76412

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Descriptors Computed from Structure

Canonical SMILES:

C1C(SC2=C(C=CC=C2Cl)N=C1C3=C(C=C(C=C3)Cl)Cl)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1C(SC2=C(C=CC=C2Cl)N=C1C3=C(C=C(C=C3)Cl)Cl)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H13Cl3N2O2S/c22-13-6-9-15(17(24)10-13)19-11-20(12-4-7-14(8-5-12)26(27)28)29-21-16(23)2-1-3-18(21)25-19/h1-10,20H,11H2