(Z)-2-(4-methoxyphenyl)-3-[2-(2-piperidin-1-ium-1-ylethoxy)phenyl]prop-2-enoate

Systemtic Name: (Z)-2-(4-methoxyphenyl)-3-[2-(2-piperidin-1-ium-1-ylethoxy)phenyl]prop-2-enoate Openeye Name: (Z)-2-(4-methoxyphenyl)-3-[2-(2-piperidin-1-ium-1-ylethoxy)phenyl]prop-2-enoate CAS Name: (Z)-2-(4-methoxyphenyl)-3-[2-[2-(1-piperidin-1-iumyl)ethoxy]phenyl]-2-propenoate IUPAC Name: (Z)-2-(4-methoxyphenyl)-3-[2-(2-piperidin-1-ium-1-ylethoxy)phenyl]prop-2-enoate Traditional Name: (Z)-2-(4-methoxyphenyl)-3-[2-(2-piperidin-1-ium-1-ylethoxy)phenyl]acrylate Formula: C23H27NO4 MolecularWeight: 381.46478

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=CC2=CC=CC=C2OCC[NH+]3CCCCC3)C(=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)/C(=C/C2=CC=CC=C2OCC[NH+]3CCCCC3)/C(=O)[O-]

InChI

InChI=1S/C23H27NO4/c1-27-20-11-9-18(10-12-20)21(23(25)26)17-19-7-3-4-8-22(19)28-16-15-24-13-5-2-6-14-24/h3-4,7-12,17H,2,5-6,13-16H2,1H3,(H,25,26)/b21-17-