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

Systemtic Name: 1-[2-[[(1R)-1-(4-methylphenyl)propyl]amino]-2-oxidanylidene-ethyl]piperidin-1-ium-4-carboxamide Openeye Name: 1-[2-oxo-2-[[(1R)-1-(p-tolyl)propyl]amino]ethyl]piperidin-1-ium-4-carboxamide CAS Name: 1-[2-[[(1R)-1-(4-methylphenyl)propyl]amino]-2-oxoethyl]-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[2-[[(1R)-1-(4-methylphenyl)propyl]amino]-2-oxoethyl]piperidin-1-ium-4-carboxamide Traditional Name: 1-[2-keto-2-[[(1R)-1-(p-tolyl)propyl]amino]ethyl]piperidin-1-ium-4-carboxamide Formula: C18H28N3O2+ MolecularWeight: 318.43382

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC[C@H](C1=CC=C(C=C1)C)NC(=O)C[NH+]2CCC(CC2)C(=O)N

InChI

InChI=1S/C18H27N3O2/c1-3-16(14-6-4-13(2)5-7-14)20-17(22)12-21-10-8-15(9-11-21)18(19)23/h4-7,15-16H,3,8-12H2,1-2H3,(H2,19,23)(H,20,22)/p+1/t16-/m1/s1