[(2R)-1-(azepan-1-yl)-1-oxidanylidene-propan-2-yl] quinoline-8-carboxylate

Systemtic Name: [(2R)-1-(azepan-1-yl)-1-oxidanylidene-propan-2-yl] quinoline-8-carboxylate Openeye Name: [(1R)-2-(azepan-1-yl)-1-methyl-2-oxo-ethyl] quinoline-8-carboxylate CAS Name: 8-quinolinecarboxylic acid [(2R)-1-(1-azepanyl)-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(azepan-1-yl)-1-oxopropan-2-yl] quinoline-8-carboxylate Traditional Name: quinoline-8-carboxylic acid [(1R)-2-(azepan-1-yl)-2-keto-1-methyl-ethyl] ester Formula: C19H22N2O3 MolecularWeight: 326.38958

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCCCCC1)OC(=O)C2=CC=CC3=C2N=CC=C3

Isomeric SMILES

C[C@H](C(=O)N1CCCCCC1)OC(=O)C2=CC=CC3=C2N=CC=C3

InChI

InChI=1S/C19H22N2O3/c1-14(18(22)21-12-4-2-3-5-13-21)24-19(23)16-10-6-8-15-9-7-11-20-17(15)16/h6-11,14H,2-5,12-13H2,1H3/t14-/m1/s1