ethyl (3R)-1-(3-oxidanylidene-3-phenylazanyl-propyl)piperidin-1-ium-3-carboxylate

Systemtic Name: ethyl (3R)-1-(3-oxidanylidene-3-phenylazanyl-propyl)piperidin-1-ium-3-carboxylate Openeye Name: ethyl (3R)-1-(3-anilino-3-oxo-propyl)piperidin-1-ium-3-carboxylate CAS Name: (3R)-1-(3-anilino-3-oxopropyl)-3-piperidin-1-iumcarboxylic acid ethyl ester IUPAC Name: ethyl (3R)-1-(3-anilino-3-oxopropyl)piperidin-1-ium-3-carboxylate Traditional Name: (3R)-1-(3-anilino-3-keto-propyl)piperidin-1-ium-3-carboxylic acid ethyl ester Formula: C17H25N2O3+ MolecularWeight: 305.392

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCC[NH+](C1)CCC(=O)NC2=CC=CC=C2

Isomeric SMILES

CCOC(=O)[C@@H]1CCC[NH+](C1)CCC(=O)NC2=CC=CC=C2

InChI

InChI=1S/C17H24N2O3/c1-2-22-17(21)14-7-6-11-19(13-14)12-10-16(20)18-15-8-4-3-5-9-15/h3-5,8-9,14H,2,6-7,10-13H2,1H3,(H,18,20)/p+1/t14-/m1/s1