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

Systemtic Name: propyl 4-(5-bromanyl-2-oxidanyl-phenyl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline-8-carboxylate Openeye Name: propyl 4-(5-bromo-2-hydroxy-phenyl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline-8-carboxylate CAS Name: 4-(5-bromo-2-hydroxyphenyl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline-8-carboxylic acid propyl ester IUPAC Name: propyl 4-(5-bromo-2-hydroxyphenyl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline-8-carboxylate Traditional Name: 4-(5-bromo-2-hydroxy-phenyl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline-8-carboxylic acid propyl ester Formula: C22H22BrNO3 MolecularWeight: 428.31898

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=CC2=C(C=C1)NC(C3C2C=CC3)C4=C(C=CC(=C4)Br)O

Isomeric SMILES

CCCOC(=O)C1=CC2=C(C=C1)NC(C3C2C=CC3)C4=C(C=CC(=C4)Br)O

InChI

InChI=1S/C22H22BrNO3/c1-2-10-27-22(26)13-6-8-19-17(11-13)15-4-3-5-16(15)21(24-19)18-12-14(23)7-9-20(18)25/h3-4,6-9,11-12,15-16,21,24-25H,2,5,10H2,1H3