N-[(1-methylpiperidin-1-ium-4-yl)methyl]-N-phenethyl-but-3-enamide

Systemtic Name: N-[(1-methylpiperidin-1-ium-4-yl)methyl]-N-phenethyl-but-3-enamide Openeye Name: N-[(1-methylpiperidin-1-ium-4-yl)methyl]-N-phenethyl-but-3-enamide CAS Name: N-[(1-methyl-4-piperidin-1-iumyl)methyl]-N-phenethyl-3-butenamide IUPAC Name: N-[(1-methylpiperidin-1-ium-4-yl)methyl]-N-phenethylbut-3-enamide Traditional Name: N-[(1-methylpiperidin-1-ium-4-yl)methyl]-N-phenethyl-but-3-enamide Formula: C19H29N2O+ MolecularWeight: 301.44636

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC(CC1)CN(CCC2=CC=CC=C2)C(=O)CC=C

Isomeric SMILES

C[NH+]1CCC(CC1)CN(CCC2=CC=CC=C2)C(=O)CC=C

InChI

InChI=1S/C19H28N2O/c1-3-7-19(22)21(15-12-17-8-5-4-6-9-17)16-18-10-13-20(2)14-11-18/h3-6,8-9,18H,1,7,10-16H2,2H3/p+1