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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC2=CC=CC=C12)C)C(=O)OC3CCCCNC3=O

Isomeric SMILES

CC1=C(C(=NC2=CC=CC=C12)C)C(=O)OC3CCCCNC3=O

InChI

InChI=1S/C18H20N2O3/c1-11-13-7-3-4-8-14(13)20-12(2)16(11)18(22)23-15-9-5-6-10-19-17(15)21/h3-4,7-8,15H,5-6,9-10H2,1-2H3,(H,19,21)