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

Systemtic Name: (3R)-1-[2-[(3,4-diethoxyphenyl)amino]-2-oxidanylidene-ethyl]piperidin-1-ium-3-carboxamide Openeye Name: (3R)-1-[2-(3,4-diethoxyanilino)-2-oxo-ethyl]piperidin-1-ium-3-carboxamide CAS Name: (3R)-1-[2-(3,4-diethoxyanilino)-2-oxoethyl]-3-piperidin-1-iumcarboxamide IUPAC Name: (3R)-1-[2-(3,4-diethoxyanilino)-2-oxoethyl]piperidin-1-ium-3-carboxamide Traditional Name: (3R)-1-[2-(3,4-diethoxyanilino)-2-keto-ethyl]piperidin-1-ium-3-carboxamide Formula: C18H28N3O4+ MolecularWeight: 350.43262

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)NC(=O)C[NH+]2CCCC(C2)C(=O)N)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)NC(=O)C[NH+]2CCC[C@H](C2)C(=O)N)OCC

InChI

InChI=1S/C18H27N3O4/c1-3-24-15-8-7-14(10-16(15)25-4-2)20-17(22)12-21-9-5-6-13(11-21)18(19)23/h7-8,10,13H,3-6,9,11-12H2,1-2H3,(H2,19,23)(H,20,22)/p+1/t13-/m1/s1