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

Systemtic Name: ethyl 4-[4-[[(E)-3-(2-methoxyphenyl)prop-2-enoyl]amino]butanoylamino]piperidine-1-carboxylate Openeye Name: ethyl 4-[4-[[(E)-3-(2-methoxyphenyl)prop-2-enoyl]amino]butanoylamino]piperidine-1-carboxylate CAS Name: 4-[[4-[[(E)-3-(2-methoxyphenyl)-1-oxoprop-2-enyl]amino]-1-oxobutyl]amino]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[4-[[(E)-3-(2-methoxyphenyl)prop-2-enoyl]amino]butanoylamino]piperidine-1-carboxylate Traditional Name: 4-[4-[[(E)-3-(2-methoxyphenyl)acryloyl]amino]butanoylamino]piperidine-1-carboxylic acid ethyl ester Formula: C22H31N3O5 MolecularWeight: 417.49864

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)NC(=O)CCCNC(=O)C=CC2=CC=CC=C2OC

Isomeric SMILES

CCOC(=O)N1CCC(CC1)NC(=O)CCCNC(=O)/C=C/C2=CC=CC=C2OC

InChI

InChI=1S/C22H31N3O5/c1-3-30-22(28)25-15-12-18(13-16-25)24-21(27)9-6-14-23-20(26)11-10-17-7-4-5-8-19(17)29-2/h4-5,7-8,10-11,18H,3,6,9,12-16H2,1-2H3,(H,23,26)(H,24,27)/b11-10+