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

Systemtic Name: cyclohexyl 2-[3-[[1-[(E)-3-piperidin-4-ylprop-2-enoyl]piperidin-3-yl]carbonylamino]propanoyloxy]propanoate Openeye Name: cyclohexyl 2-[3-[[1-[(E)-3-(4-piperidyl)prop-2-enoyl]piperidine-3-carbonyl]amino]propanoyloxy]propanoate CAS Name: 2-[1-oxo-3-[[oxo-[1-[(E)-1-oxo-3-(4-piperidinyl)prop-2-enyl]-3-piperidinyl]methyl]amino]propoxy]propanoic acid cyclohexyl ester IUPAC Name: cyclohexyl 2-[3-[[1-[(E)-3-piperidin-4-ylprop-2-enoyl]piperidine-3-carbonyl]amino]propanoyloxy]propanoate Traditional Name: 2-[3-[[1-[(E)-3-(4-piperidyl)acryloyl]nipecotoyl]amino]propanoyloxy]propionic acid cyclohexyl ester Formula: C26H41N3O6 MolecularWeight: 491.62024

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OC1CCCCC1)OC(=O)CCNC(=O)C2CCCN(C2)C(=O)C=CC3CCNCC3

Isomeric SMILES

CC(C(=O)OC1CCCCC1)OC(=O)CCNC(=O)C2CCCN(C2)C(=O)/C=C/C3CCNCC3

InChI

InChI=1S/C26H41N3O6/c1-19(26(33)35-22-7-3-2-4-8-22)34-24(31)13-16-28-25(32)21-6-5-17-29(18-21)23(30)10-9-20-11-14-27-15-12-20/h9-10,19-22,27H,2-8,11-18H2,1H3,(H,28,32)/b10-9+