ethyl 4-[[(E)-3-(1,3-diphenylpyrazol-4-yl)prop-2-enoyl]amino]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[[(E)-3-(1,3-diphenylpyrazol-4-yl)prop-2-enoyl]amino]piperidine-1-carboxylate Openeye Name: ethyl 4-[[(E)-3-(1,3-diphenylpyrazol-4-yl)prop-2-enoyl]amino]piperidine-1-carboxylate CAS Name: 4-[[(E)-3-(1,3-diphenyl-4-pyrazolyl)-1-oxoprop-2-enyl]amino]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[(E)-3-(1,3-diphenylpyrazol-4-yl)prop-2-enoyl]amino]piperidine-1-carboxylate Traditional Name: 4-[[(E)-3-(1,3-diphenylpyrazol-4-yl)acryloyl]amino]piperidine-1-carboxylic acid ethyl ester Formula: C26H28N4O3 MolecularWeight: 444.52552

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H28N4O3/c1-2-33-26(32)29-17-15-22(16-18-29)27-24(31)14-13-21-19-30(23-11-7-4-8-12-23)28-25(21)20-9-5-3-6-10-20/h3-14,19,22H,2,15-18H2,1H3,(H,27,31)/b14-13+