propan-2-yl 4-[2-oxidanylidene-1-[4-(1,2,4-triazol-1-yl)phenyl]pyridin-4-yl]oxypiperidine-1-carboxylate

Systemtic Name: propan-2-yl 4-[2-oxidanylidene-1-[4-(1,2,4-triazol-1-yl)phenyl]pyridin-4-yl]oxypiperidine-1-carboxylate Openeye Name: isopropyl 4-[[2-oxo-1-[4-(1,2,4-triazol-1-yl)phenyl]-4-pyridyl]oxy]piperidine-1-carboxylate CAS Name: 4-[[2-oxo-1-[4-(1,2,4-triazol-1-yl)phenyl]-4-pyridinyl]oxy]-1-piperidinecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-[2-oxo-1-[4-(1,2,4-triazol-1-yl)phenyl]pyridin-4-yl]oxypiperidine-1-carboxylate Traditional Name: 4-[[2-keto-1-[4-(1,2,4-triazol-1-yl)phenyl]-4-pyridyl]oxy]piperidine-1-carboxylic acid isopropyl ester Formula: C22H25N5O4 MolecularWeight: 423.465

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)N1CCC(CC1)OC2=CC(=O)N(C=C2)C3=CC=C(C=C3)N4C=NC=N4

Isomeric SMILES

CC(C)OC(=O)N1CCC(CC1)OC2=CC(=O)N(C=C2)C3=CC=C(C=C3)N4C=NC=N4

InChI

InChI=1S/C22H25N5O4/c1-16(2)30-22(29)25-10-7-19(8-11-25)31-20-9-12-26(21(28)13-20)17-3-5-18(6-4-17)27-15-23-14-24-27/h3-6,9,12-16,19H,7-8,10-11H2,1-2H3