4-(5-bromanyl-2-oxidanyl-phenyl)-N-(phenylmethyl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline-6-carboxamide

Systemtic Name: 4-(5-bromanyl-2-oxidanyl-phenyl)-N-(phenylmethyl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline-6-carboxamide Openeye Name: N-benzyl-4-(5-bromo-2-hydroxy-phenyl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline-6-carboxamide CAS Name: 4-(5-bromo-2-hydroxyphenyl)-N-(phenylmethyl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline-6-carboxamide IUPAC Name: N-benzyl-4-(5-bromo-2-hydroxyphenyl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline-6-carboxamide Traditional Name: N-benzyl-4-(5-bromo-2-hydroxy-phenyl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline-6-carboxamide Formula: C26H23BrN2O2 MolecularWeight: 475.37702

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Descriptors Computed from Structure

Canonical SMILES:

C1C=CC2C1C(NC3=C(C=CC=C23)C(=O)NCC4=CC=CC=C4)C5=C(C=CC(=C5)Br)O

Isomeric SMILES

C1C=CC2C1C(NC3=C(C=CC=C23)C(=O)NCC4=CC=CC=C4)C5=C(C=CC(=C5)Br)O

InChI

InChI=1S/C26H23BrN2O2/c27-17-12-13-23(30)22(14-17)25-20-9-4-8-18(20)19-10-5-11-21(24(19)29-25)26(31)28-15-16-6-2-1-3-7-16/h1-8,10-14,18,20,25,29-30H,9,15H2,(H,28,31)