ethyl 4-[(2-oxidanyl-4-oxidanylidene-1H-quinolin-3-yl)methyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[(2-oxidanyl-4-oxidanylidene-1H-quinolin-3-yl)methyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[(2-hydroxy-4-oxo-1H-quinolin-3-yl)methyl]piperazine-1-carboxylate CAS Name: 4-[(2-hydroxy-4-oxo-1H-quinolin-3-yl)methyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(2-hydroxy-4-oxo-1H-quinolin-3-yl)methyl]piperazine-1-carboxylate Traditional Name: 4-[(2-hydroxy-4-keto-1H-quinolin-3-yl)methyl]piperazine-1-carboxylic acid ethyl ester Formula: C17H21N3O4 MolecularWeight: 331.36634

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)CC2=C(NC3=CC=CC=C3C2=O)O

Isomeric SMILES

CCOC(=O)N1CCN(CC1)CC2=C(NC3=CC=CC=C3C2=O)O

InChI

InChI=1S/C17H21N3O4/c1-2-24-17(23)20-9-7-19(8-10-20)11-13-15(21)12-5-3-4-6-14(12)18-16(13)22/h3-6H,2,7-11H2,1H3,(H2,18,21,22)