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

Systemtic Name: (3R)-1-[2-[(3,4-diethoxyphenyl)amino]-2-oxidanylidene-ethyl]-N-phenyl-piperidin-1-ium-3-carboxamide Openeye Name: (3R)-1-[2-(3,4-diethoxyanilino)-2-oxo-ethyl]-N-phenyl-piperidin-1-ium-3-carboxamide CAS Name: (3R)-1-[2-(3,4-diethoxyanilino)-2-oxoethyl]-N-phenyl-3-piperidin-1-iumcarboxamide IUPAC Name: (3R)-1-[2-(3,4-diethoxyanilino)-2-oxoethyl]-N-phenylpiperidin-1-ium-3-carboxamide Traditional Name: (3R)-1-[2-(3,4-diethoxyanilino)-2-keto-ethyl]-N-phenyl-piperidin-1-ium-3-carboxamide Formula: C24H32N3O4+ MolecularWeight: 426.52858

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)NC(=O)C[NH+]2CCCC(C2)C(=O)NC3=CC=CC=C3)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)NC(=O)C[NH+]2CCC[C@H](C2)C(=O)NC3=CC=CC=C3)OCC

InChI

InChI=1S/C24H31N3O4/c1-3-30-21-13-12-20(15-22(21)31-4-2)25-23(28)17-27-14-8-9-18(16-27)24(29)26-19-10-6-5-7-11-19/h5-7,10-13,15,18H,3-4,8-9,14,16-17H2,1-2H3,(H,25,28)(H,26,29)/p+1/t18-/m1/s1