ethyl 3-[[1-[(E)-3-piperidin-4-ylprop-2-enoyl]piperidin-3-yl]carbonylamino]propanoate

Systemtic Name: ethyl 3-[[1-[(E)-3-piperidin-4-ylprop-2-enoyl]piperidin-3-yl]carbonylamino]propanoate Openeye Name: ethyl 3-[[1-[(E)-3-(4-piperidyl)prop-2-enoyl]piperidine-3-carbonyl]amino]propanoate CAS Name: 3-[[oxo-[1-[(E)-1-oxo-3-(4-piperidinyl)prop-2-enyl]-3-piperidinyl]methyl]amino]propanoic acid ethyl ester IUPAC Name: ethyl 3-[[1-[(E)-3-piperidin-4-ylprop-2-enoyl]piperidine-3-carbonyl]amino]propanoate Traditional Name: 3-[[1-[(E)-3-(4-piperidyl)acryloyl]nipecotoyl]amino]propionic acid ethyl ester Formula: C19H31N3O4 MolecularWeight: 365.46714

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCNC(=O)C1CCCN(C1)C(=O)C=CC2CCNCC2

Isomeric SMILES

CCOC(=O)CCNC(=O)C1CCCN(C1)C(=O)/C=C/C2CCNCC2

InChI

InChI=1S/C19H31N3O4/c1-2-26-18(24)9-12-21-19(25)16-4-3-13-22(14-16)17(23)6-5-15-7-10-20-11-8-15/h5-6,15-16,20H,2-4,7-14H2,1H3,(H,21,25)/b6-5+