ethyl 1-[3-[5-oxidanylidene-3-(4-propan-2-yloxyphenyl)-2H-1,2,4-triazin-6-yl]propanoyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[3-[5-oxidanylidene-3-(4-propan-2-yloxyphenyl)-2H-1,2,4-triazin-6-yl]propanoyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[3-[3-(4-isopropoxyphenyl)-5-oxo-2H-1,2,4-triazin-6-yl]propanoyl]piperidine-4-carboxylate CAS Name: 1-[1-oxo-3-[5-oxo-3-(4-propan-2-yloxyphenyl)-2H-1,2,4-triazin-6-yl]propyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[3-[5-oxo-3-(4-propan-2-yloxyphenyl)-2H-1,2,4-triazin-6-yl]propanoyl]piperidine-4-carboxylate Traditional Name: 1-[3-[3-(4-isopropoxyphenyl)-5-keto-2H-1,2,4-triazin-6-yl]propanoyl]isonipecotic acid ethyl ester Formula: C23H30N4O5 MolecularWeight: 442.5081

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)CCC2=NNC(=NC2=O)C3=CC=C(C=C3)OC(C)C

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)CCC2=NNC(=NC2=O)C3=CC=C(C=C3)OC(C)C

InChI

InChI=1S/C23H30N4O5/c1-4-31-23(30)17-11-13-27(14-12-17)20(28)10-9-19-22(29)24-21(26-25-19)16-5-7-18(8-6-16)32-15(2)3/h5-8,15,17H,4,9-14H2,1-3H3,(H,24,26,29)