2-(2-hydroxyethyl)-4-oxidanylidene-7-piperazin-1-yl-1H-quinoline-3-carboxylic acid

Systemtic Name: 2-(2-hydroxyethyl)-4-oxidanylidene-7-piperazin-1-yl-1H-quinoline-3-carboxylic acid Openeye Name: 2-(2-hydroxyethyl)-4-oxo-7-piperazin-1-yl-1H-quinoline-3-carboxylic acid CAS Name: 2-(2-hydroxyethyl)-4-oxo-7-(1-piperazinyl)-1H-quinoline-3-carboxylic acid IUPAC Name: 2-(2-hydroxyethyl)-4-oxo-7-piperazin-1-yl-1H-quinoline-3-carboxylic acid Traditional Name: 2-(2-hydroxyethyl)-4-keto-7-piperazino-1H-quinoline-3-carboxylic acid Formula: C16H19N3O4 MolecularWeight: 317.33976

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C2=CC3=C(C=C2)C(=O)C(=C(N3)CCO)C(=O)O

Isomeric SMILES

C1CN(CCN1)C2=CC3=C(C=C2)C(=O)C(=C(N3)CCO)C(=O)O

InChI

InChI=1S/C16H19N3O4/c20-8-3-12-14(16(22)23)15(21)11-2-1-10(9-13(11)18-12)19-6-4-17-5-7-19/h1-2,9,17,20H,3-8H2,(H,18,21)(H,22,23)