ethyl 3-[methyl-[[1-(phenylmethyl)pyrazol-4-yl]methyl]carbamoyl]piperidine-1-carboxylate

Systemtic Name: ethyl 3-[methyl-[[1-(phenylmethyl)pyrazol-4-yl]methyl]carbamoyl]piperidine-1-carboxylate Openeye Name: ethyl 3-[(1-benzylpyrazol-4-yl)methyl-methyl-carbamoyl]piperidine-1-carboxylate CAS Name: 3-[[methyl-[[1-(phenylmethyl)-4-pyrazolyl]methyl]amino]-oxomethyl]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 3-[(1-benzylpyrazol-4-yl)methyl-methylcarbamoyl]piperidine-1-carboxylate Traditional Name: 3-[(1-benzylpyrazol-4-yl)methyl-methyl-carbamoyl]piperidine-1-carboxylic acid ethyl ester Formula: C21H28N4O3 MolecularWeight: 384.47202

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCCC(C1)C(=O)N(C)CC2=CN(N=C2)CC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)N1CCCC(C1)C(=O)N(C)CC2=CN(N=C2)CC3=CC=CC=C3

InChI

InChI=1S/C21H28N4O3/c1-3-28-21(27)24-11-7-10-19(16-24)20(26)23(2)13-18-12-22-25(15-18)14-17-8-5-4-6-9-17/h4-6,8-9,12,15,19H,3,7,10-11,13-14,16H2,1-2H3