1-(3-chloranyl-6-ethoxycarbonyl-5-oxidanylidene-8H-1,8-naphthyridin-2-yl)-4-ethoxy-piperazine-2-carboxylic acid

Systemtic Name: 1-(3-chloranyl-6-ethoxycarbonyl-5-oxidanylidene-8H-1,8-naphthyridin-2-yl)-4-ethoxy-piperazine-2-carboxylic acid Openeye Name: 1-(3-chloro-6-ethoxycarbonyl-5-oxo-8H-1,8-naphthyridin-2-yl)-4-ethoxy-piperazine-2-carboxylic acid CAS Name: 1-(3-chloro-6-ethoxycarbonyl-5-oxo-8H-1,8-naphthyridin-2-yl)-4-ethoxy-2-piperazinecarboxylic acid IUPAC Name: 1-(3-chloro-6-ethoxycarbonyl-5-oxo-8H-1,8-naphthyridin-2-yl)-4-ethoxypiperazine-2-carboxylic acid Traditional Name: 1-(6-carbethoxy-3-chloro-5-keto-8H-1,8-naphthyridin-2-yl)-4-ethoxy-piperazine-2-carboxylic acid Formula: C18H21ClN4O6 MolecularWeight: 424.83554

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CNC2=NC(=C(C=C2C1=O)Cl)N3CCN(CC3C(=O)O)OCC

Isomeric SMILES

CCOC(=O)C1=CNC2=NC(=C(C=C2C1=O)Cl)N3CCN(CC3C(=O)O)OCC

InChI

InChI=1S/C18H21ClN4O6/c1-3-28-18(27)11-8-20-15-10(14(11)24)7-12(19)16(21-15)23-6-5-22(29-4-2)9-13(23)17(25)26/h7-8,13H,3-6,9H2,1-2H3,(H,25,26)(H,20,21,24)