(2-oxidanylideneazepan-3-yl) 2,6-dimethylquinoline-4-carboxylate

Systemtic Name: (2-oxidanylideneazepan-3-yl) 2,6-dimethylquinoline-4-carboxylate Openeye Name: (2-oxoazepan-3-yl) 2,6-dimethylquinoline-4-carboxylate CAS Name: 2,6-dimethyl-4-quinolinecarboxylic acid (2-oxo-3-azepanyl) ester IUPAC Name: (2-oxoazepan-3-yl) 2,6-dimethylquinoline-4-carboxylate Traditional Name: 2,6-dimethylcinchoninic acid (2-ketoazepan-3-yl) ester Formula: C18H20N2O3 MolecularWeight: 312.363

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(C=C2C(=O)OC3CCCCNC3=O)C

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(C=C2C(=O)OC3CCCCNC3=O)C

InChI

InChI=1S/C18H20N2O3/c1-11-6-7-15-13(9-11)14(10-12(2)20-15)18(22)23-16-5-3-4-8-19-17(16)21/h6-7,9-10,16H,3-5,8H2,1-2H3,(H,19,21)