methyl 2-[4-[(E)-3-(1-piperidin-4-ylimidazol-4-yl)prop-2-enoyl]piperazin-1-yl]ethanoate

Systemtic Name: methyl 2-[4-[(E)-3-(1-piperidin-4-ylimidazol-4-yl)prop-2-enoyl]piperazin-1-yl]ethanoate Openeye Name: methyl 2-[4-[(E)-3-[1-(4-piperidyl)imidazol-4-yl]prop-2-enoyl]piperazin-1-yl]acetate CAS Name: 2-[4-[(E)-1-oxo-3-[1-(4-piperidinyl)-4-imidazolyl]prop-2-enyl]-1-piperazinyl]acetic acid methyl ester IUPAC Name: methyl 2-[4-[(E)-3-(1-piperidin-4-ylimidazol-4-yl)prop-2-enoyl]piperazin-1-yl]acetate Traditional Name: 2-[4-[(E)-3-[1-(4-piperidyl)imidazol-4-yl]acryloyl]piperazino]acetic acid methyl ester Formula: C18H27N5O3 MolecularWeight: 361.43868

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CN1CCN(CC1)C(=O)C=CC2=CN(C=N2)C3CCNCC3

Isomeric SMILES

COC(=O)CN1CCN(CC1)C(=O)/C=C/C2=CN(C=N2)C3CCNCC3

InChI

InChI=1S/C18H27N5O3/c1-26-18(25)13-21-8-10-22(11-9-21)17(24)3-2-15-12-23(14-20-15)16-4-6-19-7-5-16/h2-3,12,14,16,19H,4-11,13H2,1H3/b3-2+