[2-oxidanylidene-2-[phenyl(propan-2-yl)amino]ethyl] 1-pyrimidin-2-ylpiperidine-2-carboxylate

Systemtic Name: [2-oxidanylidene-2-[phenyl(propan-2-yl)amino]ethyl] 1-pyrimidin-2-ylpiperidine-2-carboxylate Openeye Name: [2-(N-isopropylanilino)-2-oxo-ethyl] 1-pyrimidin-2-ylpiperidine-2-carboxylate CAS Name: 1-(2-pyrimidinyl)-2-piperidinecarboxylic acid [2-oxo-2-(N-propan-2-ylanilino)ethyl] ester IUPAC Name: [2-oxo-2-(N-propan-2-ylanilino)ethyl] 1-pyrimidin-2-ylpiperidine-2-carboxylate Traditional Name: 1-(2-pyrimidyl)pipecolinic acid [2-(N-isopropylanilino)-2-keto-ethyl] ester Formula: C21H26N4O3 MolecularWeight: 382.45614

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(C1=CC=CC=C1)C(=O)COC(=O)C2CCCCN2C3=NC=CC=N3

Isomeric SMILES

CC(C)N(C1=CC=CC=C1)C(=O)COC(=O)C2CCCCN2C3=NC=CC=N3

InChI

InChI=1S/C21H26N4O3/c1-16(2)25(17-9-4-3-5-10-17)19(26)15-28-20(27)18-11-6-7-14-24(18)21-22-12-8-13-23-21/h3-5,8-10,12-13,16,18H,6-7,11,14-15H2,1-2H3