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

Systemtic Name: ethyl 4-[4-[[(E)-2-cyano-3-(3-methoxyphenyl)prop-2-enoyl]amino]butanoylamino]piperidine-1-carboxylate Openeye Name: ethyl 4-[4-[[(E)-2-cyano-3-(3-methoxyphenyl)prop-2-enoyl]amino]butanoylamino]piperidine-1-carboxylate CAS Name: 4-[[4-[[(E)-2-cyano-3-(3-methoxyphenyl)-1-oxoprop-2-enyl]amino]-1-oxobutyl]amino]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[4-[[(E)-2-cyano-3-(3-methoxyphenyl)prop-2-enoyl]amino]butanoylamino]piperidine-1-carboxylate Traditional Name: 4-[4-[[(E)-2-cyano-3-(3-methoxyphenyl)acryloyl]amino]butanoylamino]piperidine-1-carboxylic acid ethyl ester Formula: C23H30N4O5 MolecularWeight: 442.5081

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)NC(=O)CCCNC(=O)C(=CC2=CC(=CC=C2)OC)C#N

Isomeric SMILES

CCOC(=O)N1CCC(CC1)NC(=O)CCCNC(=O)/C(=C/C2=CC(=CC=C2)OC)/C#N

InChI

InChI=1S/C23H30N4O5/c1-3-32-23(30)27-12-9-19(10-13-27)26-21(28)8-5-11-25-22(29)18(16-24)14-17-6-4-7-20(15-17)31-2/h4,6-7,14-15,19H,3,5,8-13H2,1-2H3,(H,25,29)(H,26,28)/b18-14+