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

Systemtic Name: ethyl 4-[4-[[(E)-3-(1-phenylpyrazol-4-yl)prop-2-enoyl]amino]butanoylamino]piperidine-1-carboxylate Openeye Name: ethyl 4-[4-[[(E)-3-(1-phenylpyrazol-4-yl)prop-2-enoyl]amino]butanoylamino]piperidine-1-carboxylate CAS Name: 4-[[1-oxo-4-[[(E)-1-oxo-3-(1-phenyl-4-pyrazolyl)prop-2-enyl]amino]butyl]amino]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[4-[[(E)-3-(1-phenylpyrazol-4-yl)prop-2-enoyl]amino]butanoylamino]piperidine-1-carboxylate Traditional Name: 4-[4-[[(E)-3-(1-phenylpyrazol-4-yl)acryloyl]amino]butanoylamino]piperidine-1-carboxylic acid ethyl ester Formula: C24H31N5O4 MolecularWeight: 453.53404

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)NC(=O)CCCNC(=O)C=CC2=CN(N=C2)C3=CC=CC=C3

Isomeric SMILES

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

InChI

InChI=1S/C24H31N5O4/c1-2-33-24(32)28-15-12-20(13-16-28)27-23(31)9-6-14-25-22(30)11-10-19-17-26-29(18-19)21-7-4-3-5-8-21/h3-5,7-8,10-11,17-18,20H,2,6,9,12-16H2,1H3,(H,25,30)(H,27,31)/b11-10+