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

Systemtic Name: 4-(5-bromanyl-2-oxidanyl-phenyl)-N-(phenylmethyl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline-8-sulfonamide Openeye Name: N-benzyl-4-(5-bromo-2-hydroxy-phenyl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline-8-sulfonamide CAS Name: 4-(5-bromo-2-hydroxyphenyl)-N-(phenylmethyl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline-8-sulfonamide IUPAC Name: N-benzyl-4-(5-bromo-2-hydroxyphenyl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline-8-sulfonamide Traditional Name: N-benzyl-4-(5-bromo-2-hydroxy-phenyl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline-8-sulfonamide Formula: C25H23BrN2O3S MolecularWeight: 511.43072

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Descriptors Computed from Structure

Canonical SMILES:

C1C=CC2C1C(NC3=C2C=C(C=C3)S(=O)(=O)NCC4=CC=CC=C4)C5=C(C=CC(=C5)Br)O

Isomeric SMILES

C1C=CC2C1C(NC3=C2C=C(C=C3)S(=O)(=O)NCC4=CC=CC=C4)C5=C(C=CC(=C5)Br)O

InChI

InChI=1S/C25H23BrN2O3S/c26-17-9-12-24(29)22(13-17)25-20-8-4-7-19(20)21-14-18(10-11-23(21)28-25)32(30,31)27-15-16-5-2-1-3-6-16/h1-7,9-14,19-20,25,27-29H,8,15H2