4-(5-nitro-2-oxidanyl-phenyl)-N-phenethyl-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline-8-sulfonamide

Systemtic Name: 4-(5-nitro-2-oxidanyl-phenyl)-N-phenethyl-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline-8-sulfonamide Openeye Name: 4-(2-hydroxy-5-nitro-phenyl)-N-phenethyl-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline-8-sulfonamide CAS Name: 4-(2-hydroxy-5-nitrophenyl)-N-phenethyl-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline-8-sulfonamide IUPAC Name: 4-(2-hydroxy-5-nitrophenyl)-N-phenethyl-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline-8-sulfonamide Traditional Name: 4-(2-hydroxy-5-nitro-phenyl)-N-phenethyl-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline-8-sulfonamide Formula: C26H25N3O5S MolecularWeight: 491.5588

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Descriptors Computed from Structure

Canonical SMILES:

C1C=CC2C1C(NC3=C2C=C(C=C3)S(=O)(=O)NCCC4=CC=CC=C4)C5=C(C=CC(=C5)[N+](=O)[O-])O

Isomeric SMILES

C1C=CC2C1C(NC3=C2C=C(C=C3)S(=O)(=O)NCCC4=CC=CC=C4)C5=C(C=CC(=C5)[N+](=O)[O-])O

InChI

InChI=1S/C26H25N3O5S/c30-25-12-9-18(29(31)32)15-23(25)26-21-8-4-7-20(21)22-16-19(10-11-24(22)28-26)35(33,34)27-14-13-17-5-2-1-3-6-17/h1-7,9-12,15-16,20-21,26-28,30H,8,13-14H2