ethyl 4-[(6-nitro-7-oxidanylidene-2-piperidin-1-yl-8H-1,8-naphthyridin-4-yl)methyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[(6-nitro-7-oxidanylidene-2-piperidin-1-yl-8H-1,8-naphthyridin-4-yl)methyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[[6-nitro-7-oxo-2-(1-piperidyl)-8H-1,8-naphthyridin-4-yl]methyl]piperazine-1-carboxylate CAS Name: 4-[[6-nitro-7-oxo-2-(1-piperidinyl)-8H-1,8-naphthyridin-4-yl]methyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(6-nitro-7-oxo-2-piperidin-1-yl-8H-1,8-naphthyridin-4-yl)methyl]piperazine-1-carboxylate Traditional Name: 4-[(7-keto-6-nitro-2-piperidino-8H-1,8-naphthyridin-4-yl)methyl]piperazine-1-carboxylic acid ethyl ester Formula: C21H28N6O5 MolecularWeight: 444.48422

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)CC2=CC(=NC3=C2C=C(C(=O)N3)[N+](=O)[O-])N4CCCCC4

Isomeric SMILES

CCOC(=O)N1CCN(CC1)CC2=CC(=NC3=C2C=C(C(=O)N3)[N+](=O)[O-])N4CCCCC4

InChI

InChI=1S/C21H28N6O5/c1-2-32-21(29)26-10-8-24(9-11-26)14-15-12-18(25-6-4-3-5-7-25)22-19-16(15)13-17(27(30)31)20(28)23-19/h12-13H,2-11,14H2,1H3,(H,22,23,28)