1-[2-[(4-methylphenyl)methyl-propyl-amino]-2-oxidanylidene-ethyl]piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[2-[(4-methylphenyl)methyl-propyl-amino]-2-oxidanylidene-ethyl]piperidin-1-ium-4-carboxamide Openeye Name: 1-[2-oxo-2-[propyl(p-tolylmethyl)amino]ethyl]piperidin-1-ium-4-carboxamide CAS Name: 1-[2-[(4-methylphenyl)methyl-propylamino]-2-oxoethyl]-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[2-[(4-methylphenyl)methyl-propylamino]-2-oxoethyl]piperidin-1-ium-4-carboxamide Traditional Name: 1-[2-keto-2-[(4-methylbenzyl)-propyl-amino]ethyl]piperidin-1-ium-4-carboxamide Formula: C19H30N3O2+ MolecularWeight: 332.4604

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC1=CC=C(C=C1)C)C(=O)C[NH+]2CCC(CC2)C(=O)N

Isomeric SMILES

CCCN(CC1=CC=C(C=C1)C)C(=O)C[NH+]2CCC(CC2)C(=O)N

InChI

InChI=1S/C19H29N3O2/c1-3-10-22(13-16-6-4-15(2)5-7-16)18(23)14-21-11-8-17(9-12-21)19(20)24/h4-7,17H,3,8-14H2,1-2H3,(H2,20,24)/p+1