2-[(1R,2S)-2-methylcyclohexyl]oxyquinoline-3-carboxylate

Systemtic Name: 2-[(1R,2S)-2-methylcyclohexyl]oxyquinoline-3-carboxylate Openeye Name: 2-[(1R,2S)-2-methylcyclohexoxy]quinoline-3-carboxylate CAS Name: 2-[(1R,2S)-2-methylcyclohexyl]oxy-3-quinolinecarboxylate IUPAC Name: 2-[(1R,2S)-2-methylcyclohexyl]oxyquinoline-3-carboxylate Traditional Name: 2-[(1R,2S)-2-methylcyclohexoxy]quinoline-3-carboxylate Formula: C17H18NO3- MolecularWeight: 284.32972

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1OC2=NC3=CC=CC=C3C=C2C(=O)[O-]

Isomeric SMILES

C[C@H]1CCCC[C@H]1OC2=NC3=CC=CC=C3C=C2C(=O)[O-]

InChI

InChI=1S/C17H19NO3/c1-11-6-2-5-9-15(11)21-16-13(17(19)20)10-12-7-3-4-8-14(12)18-16/h3-4,7-8,10-11,15H,2,5-6,9H2,1H3,(H,19,20)/p-1/t11-,15+/m0/s1