[2-oxidanylidene-2-(oxolan-2-ylmethylamino)ethyl] 6-chloranyl-2-methyl-quinoline-3-carboxylate

Systemtic Name: [2-oxidanylidene-2-(oxolan-2-ylmethylamino)ethyl] 6-chloranyl-2-methyl-quinoline-3-carboxylate Openeye Name: [2-oxo-2-(tetrahydrofuran-2-ylmethylamino)ethyl] 6-chloro-2-methyl-quinoline-3-carboxylate CAS Name: 6-chloro-2-methyl-3-quinolinecarboxylic acid [2-oxo-2-(2-oxolanylmethylamino)ethyl] ester IUPAC Name: [2-oxo-2-(oxolan-2-ylmethylamino)ethyl] 6-chloro-2-methylquinoline-3-carboxylate Traditional Name: 6-chloro-2-methyl-quinoline-3-carboxylic acid [2-keto-2-(tetrahydrofurfurylamino)ethyl] ester Formula: C18H19ClN2O4 MolecularWeight: 362.80746

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C=C(C=CC2=N1)Cl)C(=O)OCC(=O)NCC3CCCO3

Isomeric SMILES

CC1=C(C=C2C=C(C=CC2=N1)Cl)C(=O)OCC(=O)NCC3CCCO3

InChI

InChI=1S/C18H19ClN2O4/c1-11-15(8-12-7-13(19)4-5-16(12)21-11)18(23)25-10-17(22)20-9-14-3-2-6-24-14/h4-5,7-8,14H,2-3,6,9-10H2,1H3,(H,20,22)