1-(4-chloranyl-3-nitro-phenyl)sulfonyl-3,4,5,6-tetrahydro-2H-1-benzazocine

Systemtic Name: 1-(4-chloranyl-3-nitro-phenyl)sulfonyl-3,4,5,6-tetrahydro-2H-1-benzazocine Openeye Name: 1-(4-chloro-3-nitro-phenyl)sulfonyl-3,4,5,6-tetrahydro-2H-1-benzazocine CAS Name: 1-(4-chloro-3-nitrophenyl)sulfonyl-3,4,5,6-tetrahydro-2H-1-benzazocine IUPAC Name: 1-(4-chloro-3-nitrophenyl)sulfonyl-3,4,5,6-tetrahydro-2H-1-benzazocine Traditional Name: 1-(4-chloro-3-nitro-phenyl)sulfonyl-3,4,5,6-tetrahydro-2H-1-benzazocine Formula: C17H17ClN2O4S MolecularWeight: 380.84588

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=CC=CC=C2N(CC1)S(=O)(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

C1CCC2=CC=CC=C2N(CC1)S(=O)(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C17H17ClN2O4S/c18-15-10-9-14(12-17(15)20(21)22)25(23,24)19-11-5-1-2-6-13-7-3-4-8-16(13)19/h3-4,7-10,12H,1-2,5-6,11H2