(E)-3-(4-propan-2-ylphenyl)-N-(1-propylpiperidin-1-ium-4-yl)prop-2-enamide

Systemtic Name: (E)-3-(4-propan-2-ylphenyl)-N-(1-propylpiperidin-1-ium-4-yl)prop-2-enamide Openeye Name: (E)-3-(4-isopropylphenyl)-N-(1-propylpiperidin-1-ium-4-yl)prop-2-enamide CAS Name: (E)-3-(4-propan-2-ylphenyl)-N-(1-propyl-4-piperidin-1-iumyl)-2-propenamide IUPAC Name: (E)-3-(4-propan-2-ylphenyl)-N-(1-propylpiperidin-1-ium-4-yl)prop-2-enamide Traditional Name: (E)-3-p-cumenyl-N-(1-propylpiperidin-1-ium-4-yl)acrylamide Formula: C20H31N2O+ MolecularWeight: 315.47294

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+]1CCC(CC1)NC(=O)C=CC2=CC=C(C=C2)C(C)C

Isomeric SMILES

CCC[NH+]1CCC(CC1)NC(=O)/C=C/C2=CC=C(C=C2)C(C)C

InChI

InChI=1S/C20H30N2O/c1-4-13-22-14-11-19(12-15-22)21-20(23)10-7-17-5-8-18(9-6-17)16(2)3/h5-10,16,19H,4,11-15H2,1-3H3,(H,21,23)/p+1/b10-7+