ethyl 1-[3-(4-aminophenyl)carbonyloxypropyl]piperidin-1-ium-3-carboxylate chloride

Systemtic Name: ethyl 1-[3-(4-aminophenyl)carbonyloxypropyl]piperidin-1-ium-3-carboxylate chloride Openeye Name: ethyl 1-[3-(4-aminobenzoyl)oxypropyl]piperidin-1-ium-3-carboxylate chloride CAS Name: 1-[3-[(4-aminophenyl)-oxomethoxy]propyl]-3-piperidin-1-iumcarboxylic acid ethyl ester chloride IUPAC Name: ethyl 1-[3-(4-aminobenzoyl)oxypropyl]piperidin-1-ium-3-carboxylate chloride Traditional Name: 1-[3-(4-aminobenzoyl)oxypropyl]piperidin-1-ium-3-carboxylic acid ethyl ester chloride Formula: C18H27ClN2O4 MolecularWeight: 370.87098

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCC[NH+](C1)CCCOC(=O)C2=CC=C(C=C2)N.[Cl-]

Isomeric SMILES

CCOC(=O)C1CCC[NH+](C1)CCCOC(=O)C2=CC=C(C=C2)N.[Cl-]

InChI

InChI=1S/C18H26N2O4.ClH/c1-2-23-18(22)15-5-3-10-20(13-15)11-4-12-24-17(21)14-6-8-16(19)9-7-14;/h6-9,15H,2-5,10-13,19H2,1H3;1H