ethyl 4-[(4-chlorophenyl)methyl]-1-cyclobutyl-piperidin-1-ium-4-carboxylate

Systemtic Name: ethyl 4-[(4-chlorophenyl)methyl]-1-cyclobutyl-piperidin-1-ium-4-carboxylate Openeye Name: ethyl 4-[(4-chlorophenyl)methyl]-1-cyclobutyl-piperidin-1-ium-4-carboxylate CAS Name: 4-[(4-chlorophenyl)methyl]-1-cyclobutyl-4-piperidin-1-iumcarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(4-chlorophenyl)methyl]-1-cyclobutylpiperidin-1-ium-4-carboxylate Traditional Name: 4-(4-chlorobenzyl)-1-cyclobutyl-piperidin-1-ium-4-carboxylic acid ethyl ester Formula: C19H27ClNO2+ MolecularWeight: 336.87618

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CC[NH+](CC1)C2CCC2)CC3=CC=C(C=C3)Cl

Isomeric SMILES

CCOC(=O)C1(CC[NH+](CC1)C2CCC2)CC3=CC=C(C=C3)Cl

InChI

InChI=1S/C19H26ClNO2/c1-2-23-18(22)19(14-15-6-8-16(20)9-7-15)10-12-21(13-11-19)17-4-3-5-17/h6-9,17H,2-5,10-14H2,1H3/p+1