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

Systemtic Name: methyl 4-(5-bromanyl-2-oxidanyl-phenyl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline-6-carboxylate Openeye Name: methyl 4-(5-bromo-2-hydroxy-phenyl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline-6-carboxylate CAS Name: 4-(5-bromo-2-hydroxyphenyl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline-6-carboxylic acid methyl ester IUPAC Name: methyl 4-(5-bromo-2-hydroxyphenyl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline-6-carboxylate Traditional Name: 4-(5-bromo-2-hydroxy-phenyl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline-6-carboxylic acid methyl ester Formula: C20H18BrNO3 MolecularWeight: 400.26582

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C2C(=CC=C1)C3C=CCC3C(N2)C4=C(C=CC(=C4)Br)O

Isomeric SMILES

COC(=O)C1=C2C(=CC=C1)C3C=CCC3C(N2)C4=C(C=CC(=C4)Br)O

InChI

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