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

Systemtic Name: ethyl 4-[4-[[(E)-3-(2-nitrophenyl)prop-2-enoyl]amino]butanoylamino]piperidine-1-carboxylate Openeye Name: ethyl 4-[4-[[(E)-3-(2-nitrophenyl)prop-2-enoyl]amino]butanoylamino]piperidine-1-carboxylate CAS Name: 4-[[4-[[(E)-3-(2-nitrophenyl)-1-oxoprop-2-enyl]amino]-1-oxobutyl]amino]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[4-[[(E)-3-(2-nitrophenyl)prop-2-enoyl]amino]butanoylamino]piperidine-1-carboxylate Traditional Name: 4-[4-[[(E)-3-(2-nitrophenyl)acryloyl]amino]butanoylamino]piperidine-1-carboxylic acid ethyl ester Formula: C21H28N4O6 MolecularWeight: 432.47022

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)NC(=O)CCCNC(=O)C=CC2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)N1CCC(CC1)NC(=O)CCCNC(=O)/C=C/C2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C21H28N4O6/c1-2-31-21(28)24-14-11-17(12-15-24)23-20(27)8-5-13-22-19(26)10-9-16-6-3-4-7-18(16)25(29)30/h3-4,6-7,9-10,17H,2,5,8,11-15H2,1H3,(H,22,26)(H,23,27)/b10-9+