ethyl 4-[(2,5-dimethylpyrazol-3-yl)methyl-(phenylcarbonyl)amino]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[(2,5-dimethylpyrazol-3-yl)methyl-(phenylcarbonyl)amino]piperidine-1-carboxylate Openeye Name: ethyl 4-[benzoyl-[(2,5-dimethylpyrazol-3-yl)methyl]amino]piperidine-1-carboxylate CAS Name: 4-[benzoyl-[(2,5-dimethyl-3-pyrazolyl)methyl]amino]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[benzoyl-[(2,5-dimethylpyrazol-3-yl)methyl]amino]piperidine-1-carboxylate Traditional Name: 4-[benzoyl-[(2,5-dimethylpyrazol-3-yl)methyl]amino]piperidine-1-carboxylic acid ethyl ester Formula: C21H28N4O3 MolecularWeight: 384.47202

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)N(CC2=CC(=NN2C)C)C(=O)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)N1CCC(CC1)N(CC2=CC(=NN2C)C)C(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H28N4O3/c1-4-28-21(27)24-12-10-18(11-13-24)25(15-19-14-16(2)22-23(19)3)20(26)17-8-6-5-7-9-17/h5-9,14,18H,4,10-13,15H2,1-3H3