(3R)-1-[2-[(4-ethylphenyl)amino]-2-oxidanylidene-ethyl]piperidin-1-ium-3-carboxamide

Systemtic Name: (3R)-1-[2-[(4-ethylphenyl)amino]-2-oxidanylidene-ethyl]piperidin-1-ium-3-carboxamide Openeye Name: (3R)-1-[2-(4-ethylanilino)-2-oxo-ethyl]piperidin-1-ium-3-carboxamide CAS Name: (3R)-1-[2-(4-ethylanilino)-2-oxoethyl]-3-piperidin-1-iumcarboxamide IUPAC Name: (3R)-1-[2-(4-ethylanilino)-2-oxoethyl]piperidin-1-ium-3-carboxamide Traditional Name: (3R)-1-[2-(4-ethylanilino)-2-keto-ethyl]piperidin-1-ium-3-carboxamide Formula: C16H24N3O2+ MolecularWeight: 290.38066

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=O)C[NH+]2CCCC(C2)C(=O)N

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=O)C[NH+]2CCC[C@H](C2)C(=O)N

InChI

InChI=1S/C16H23N3O2/c1-2-12-5-7-14(8-6-12)18-15(20)11-19-9-3-4-13(10-19)16(17)21/h5-8,13H,2-4,9-11H2,1H3,(H2,17,21)(H,18,20)/p+1/t13-/m1/s1