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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC(=O)C2CC[NH+](CC2)CC(=CC3=CC=CC=C3)C

Isomeric SMILES

C[C@H](C1=CC=CC=C1)NC(=O)C2CC[NH+](CC2)C/C(=C/C3=CC=CC=C3)/C

InChI

InChI=1S/C24H30N2O/c1-19(17-21-9-5-3-6-10-21)18-26-15-13-23(14-16-26)24(27)25-20(2)22-11-7-4-8-12-22/h3-12,17,20,23H,13-16,18H2,1-2H3,(H,25,27)/p+1/b19-17+/t20-/m1/s1