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

Systemtic Name: methyl 4-(5-bromanyl-2-oxidanyl-phenyl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline-8-carboxylate Openeye Name: methyl 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 methyl ester IUPAC Name: methyl 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 methyl ester Formula: C20H18BrNO3 MolecularWeight: 400.26582

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H18BrNO3/c1-25-20(24)11-5-7-17-15(9-11)13-3-2-4-14(13)19(22-17)16-10-12(21)6-8-18(16)23/h2-3,5-10,13-14,19,22-23H,4H2,1H3