1-[(E)-2-methyl-3-phenyl-prop-2-enyl]-N-phenethyl-piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[(E)-2-methyl-3-phenyl-prop-2-enyl]-N-phenethyl-piperidin-1-ium-4-carboxamide Openeye Name: 1-[(E)-2-methyl-3-phenyl-allyl]-N-phenethyl-piperidin-1-ium-4-carboxamide CAS Name: 1-[(E)-2-methyl-3-phenylprop-2-enyl]-N-phenethyl-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[(E)-2-methyl-3-phenylprop-2-enyl]-N-phenethylpiperidin-1-ium-4-carboxamide Traditional Name: 1-[(E)-2-methyl-3-phenyl-allyl]-N-phenethyl-piperidin-1-ium-4-carboxamide Formula: C24H31N2O+ MolecularWeight: 363.51574

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC1=CC=CC=C1)C[NH+]2CCC(CC2)C(=O)NCCC3=CC=CC=C3

Isomeric SMILES

C/C(=C\C1=CC=CC=C1)/C[NH+]2CCC(CC2)C(=O)NCCC3=CC=CC=C3

InChI

InChI=1S/C24H30N2O/c1-20(18-22-10-6-3-7-11-22)19-26-16-13-23(14-17-26)24(27)25-15-12-21-8-4-2-5-9-21/h2-11,18,23H,12-17,19H2,1H3,(H,25,27)/p+1/b20-18+