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

Systemtic Name: (3S)-1-[(E)-2-methyl-3-phenyl-prop-2-enyl]piperidin-1-ium-3-carboxamide Openeye Name: (3S)-1-[(E)-2-methyl-3-phenyl-allyl]piperidin-1-ium-3-carboxamide CAS Name: (3S)-1-[(E)-2-methyl-3-phenylprop-2-enyl]-3-piperidin-1-iumcarboxamide IUPAC Name: (3S)-1-[(E)-2-methyl-3-phenylprop-2-enyl]piperidin-1-ium-3-carboxamide Traditional Name: (3S)-1-[(E)-2-methyl-3-phenyl-allyl]piperidin-1-ium-3-carboxamide Formula: C16H23N2O+ MolecularWeight: 259.36662

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC1=CC=CC=C1)C[NH+]2CCCC(C2)C(=O)N

Isomeric SMILES

C/C(=C\C1=CC=CC=C1)/C[NH+]2CCC[C@@H](C2)C(=O)N

InChI

InChI=1S/C16H22N2O/c1-13(10-14-6-3-2-4-7-14)11-18-9-5-8-15(12-18)16(17)19/h2-4,6-7,10,15H,5,8-9,11-12H2,1H3,(H2,17,19)/p+1/b13-10+/t15-/m0/s1