methyl 4-[[(E)-3-(1-piperidin-4-ylimidazol-4-yl)prop-2-enoyl]amino]cyclohexane-1-carboxylate

Systemtic Name: methyl 4-[[(E)-3-(1-piperidin-4-ylimidazol-4-yl)prop-2-enoyl]amino]cyclohexane-1-carboxylate Openeye Name: methyl 4-[[(E)-3-[1-(4-piperidyl)imidazol-4-yl]prop-2-enoyl]amino]cyclohexanecarboxylate CAS Name: 4-[[(E)-1-oxo-3-[1-(4-piperidinyl)-4-imidazolyl]prop-2-enyl]amino]-1-cyclohexanecarboxylic acid methyl ester IUPAC Name: methyl 4-[[(E)-3-(1-piperidin-4-ylimidazol-4-yl)prop-2-enoyl]amino]cyclohexane-1-carboxylate Traditional Name: 4-[[(E)-3-[1-(4-piperidyl)imidazol-4-yl]acryloyl]amino]cyclohexanecarboxylic acid methyl ester Formula: C19H28N4O3 MolecularWeight: 360.45062

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CCC(CC1)NC(=O)C=CC2=CN(C=N2)C3CCNCC3

Isomeric SMILES

COC(=O)C1CCC(CC1)NC(=O)/C=C/C2=CN(C=N2)C3CCNCC3

InChI

InChI=1S/C19H28N4O3/c1-26-19(25)14-2-4-15(5-3-14)22-18(24)7-6-16-12-23(13-21-16)17-8-10-20-11-9-17/h6-7,12-15,17,20H,2-5,8-11H2,1H3,(H,22,24)/b7-6+