4-(4-chloranyl-3-nitro-phenyl)sulfonyl-5,6,7,8-tetrahydrothieno[3,2-b]azepine

Systemtic Name: 4-(4-chloranyl-3-nitro-phenyl)sulfonyl-5,6,7,8-tetrahydrothieno[3,2-b]azepine Openeye Name: 4-(4-chloro-3-nitro-phenyl)sulfonyl-5,6,7,8-tetrahydrothieno[3,2-b]azepine CAS Name: 4-(4-chloro-3-nitrophenyl)sulfonyl-5,6,7,8-tetrahydrothieno[3,2-b]azepine IUPAC Name: 4-(4-chloro-3-nitrophenyl)sulfonyl-5,6,7,8-tetrahydrothieno[3,2-b]azepine Traditional Name: 4-(4-chloro-3-nitro-phenyl)sulfonyl-5,6,7,8-tetrahydrothien[3,2-b]azepine Formula: C14H13ClN2O4S2 MolecularWeight: 372.84702

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C2=C(C1)SC=C2)S(=O)(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C2=C(C1)SC=C2)S(=O)(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C14H13ClN2O4S2/c15-11-5-4-10(9-13(11)17(18)19)23(20,21)16-7-2-1-3-14-12(16)6-8-22-14/h4-6,8-9H,1-3,7H2