ethyl 4-[[(E)-3-[3-phenyl-1-(phenylmethyl)pyrazol-4-yl]prop-2-enoyl]amino]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[[(E)-3-[3-phenyl-1-(phenylmethyl)pyrazol-4-yl]prop-2-enoyl]amino]piperidine-1-carboxylate Openeye Name: ethyl 4-[[(E)-3-(1-benzyl-3-phenyl-pyrazol-4-yl)prop-2-enoyl]amino]piperidine-1-carboxylate CAS Name: 4-[[(E)-1-oxo-3-[3-phenyl-1-(phenylmethyl)-4-pyrazolyl]prop-2-enyl]amino]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[(E)-3-(1-benzyl-3-phenylpyrazol-4-yl)prop-2-enoyl]amino]piperidine-1-carboxylate Traditional Name: 4-[[(E)-3-(1-benzyl-3-phenyl-pyrazol-4-yl)acryloyl]amino]piperidine-1-carboxylic acid ethyl ester Formula: C27H30N4O3 MolecularWeight: 458.5521

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)NC(=O)C=CC2=CN(N=C2C3=CC=CC=C3)CC4=CC=CC=C4

Isomeric SMILES

CCOC(=O)N1CCC(CC1)NC(=O)/C=C/C2=CN(N=C2C3=CC=CC=C3)CC4=CC=CC=C4

InChI

InChI=1S/C27H30N4O3/c1-2-34-27(33)30-17-15-24(16-18-30)28-25(32)14-13-23-20-31(19-21-9-5-3-6-10-21)29-26(23)22-11-7-4-8-12-22/h3-14,20,24H,2,15-19H2,1H3,(H,28,32)/b14-13+