ethyl 1-[6-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-5-nitro-pyrimidin-4-yl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[6-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-5-nitro-pyrimidin-4-yl]piperidine-4-carboxylate Openeye Name: ethyl 1-[6-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-5-nitro-pyrimidin-4-yl]piperidine-4-carboxylate CAS Name: 1-[6-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-5-nitro-4-pyrimidinyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[6-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-5-nitropyrimidin-4-yl]piperidine-4-carboxylate Traditional Name: 1-[6-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-5-nitro-pyrimidin-4-yl]isonipecotic acid ethyl ester Formula: C19H27N5O6 MolecularWeight: 421.44758

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C2=C(C(=NC=N2)N3CCC4(CC3)OCCO4)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C2=C(C(=NC=N2)N3CCC4(CC3)OCCO4)[N+](=O)[O-]

InChI

InChI=1S/C19H27N5O6/c1-2-28-18(25)14-3-7-22(8-4-14)16-15(24(26)27)17(21-13-20-16)23-9-5-19(6-10-23)29-11-12-30-19/h13-14H,2-12H2,1H3