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

Systemtic Name: ethyl 4-[7-oxidanylidene-4-(piperidin-1-ylmethyl)-8H-1,8-naphthyridin-2-yl]piperazine-1-carboxylate Openeye Name: ethyl 4-[7-oxo-4-(1-piperidylmethyl)-8H-1,8-naphthyridin-2-yl]piperazine-1-carboxylate CAS Name: 4-[7-oxo-4-(1-piperidinylmethyl)-8H-1,8-naphthyridin-2-yl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[7-oxo-4-(piperidin-1-ylmethyl)-8H-1,8-naphthyridin-2-yl]piperazine-1-carboxylate Traditional Name: 4-[7-keto-4-(piperidinomethyl)-8H-1,8-naphthyridin-2-yl]piperazine-1-carboxylic acid ethyl ester Formula: C21H29N5O3 MolecularWeight: 399.48666

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C2=NC3=C(C=CC(=O)N3)C(=C2)CN4CCCCC4

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C2=NC3=C(C=CC(=O)N3)C(=C2)CN4CCCCC4

InChI

InChI=1S/C21H29N5O3/c1-2-29-21(28)26-12-10-25(11-13-26)18-14-16(15-24-8-4-3-5-9-24)17-6-7-19(27)23-20(17)22-18/h6-7,14H,2-5,8-13,15H2,1H3,(H,22,23,27)