ethyl (3S)-1-[(4-chlorophenyl)methyl]-3-(2-methoxyethyl)piperidin-1-ium-3-carboxylate

Systemtic Name: ethyl (3S)-1-[(4-chlorophenyl)methyl]-3-(2-methoxyethyl)piperidin-1-ium-3-carboxylate Openeye Name: ethyl (3S)-1-[(4-chlorophenyl)methyl]-3-(2-methoxyethyl)piperidin-1-ium-3-carboxylate CAS Name: (3S)-1-[(4-chlorophenyl)methyl]-3-(2-methoxyethyl)-3-piperidin-1-iumcarboxylic acid ethyl ester IUPAC Name: ethyl (3S)-1-[(4-chlorophenyl)methyl]-3-(2-methoxyethyl)piperidin-1-ium-3-carboxylate Traditional Name: (3S)-1-(4-chlorobenzyl)-3-(2-methoxyethyl)piperidin-1-ium-3-carboxylic acid ethyl ester Formula: C18H27ClNO3+ MolecularWeight: 340.86488

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCC[NH+](C1)CC2=CC=C(C=C2)Cl)CCOC

Isomeric SMILES

CCOC(=O)[C@@]1(CCC[NH+](C1)CC2=CC=C(C=C2)Cl)CCOC

InChI

InChI=1S/C18H26ClNO3/c1-3-23-17(21)18(10-12-22-2)9-4-11-20(14-18)13-15-5-7-16(19)8-6-15/h5-8H,3-4,9-14H2,1-2H3/p+1/t18-/m0/s1