1-(4-chloranyl-3-nitro-phenyl)sulfonyl-2,3,4,5-tetrahydro-1-benzazepine

Systemtic Name: 1-(4-chloranyl-3-nitro-phenyl)sulfonyl-2,3,4,5-tetrahydro-1-benzazepine Openeye Name: 1-(4-chloro-3-nitro-phenyl)sulfonyl-2,3,4,5-tetrahydro-1-benzazepine CAS Name: 1-(4-chloro-3-nitrophenyl)sulfonyl-2,3,4,5-tetrahydro-1-benzazepine IUPAC Name: 1-(4-chloro-3-nitrophenyl)sulfonyl-2,3,4,5-tetrahydro-1-benzazepine Traditional Name: 1-(4-chloro-3-nitro-phenyl)sulfonyl-2,3,4,5-tetrahydro-1-benzazepine Formula: C16H15ClN2O4S MolecularWeight: 366.8193

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C2=CC=CC=C2C1)S(=O)(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C2=CC=CC=C2C1)S(=O)(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C16H15ClN2O4S/c17-14-9-8-13(11-16(14)19(20)21)24(22,23)18-10-4-3-6-12-5-1-2-7-15(12)18/h1-2,5,7-9,11H,3-4,6,10H2