ethyl 1-[3-(4-chloranyl-2-methyl-phenoxy)propyl]piperidin-1-ium-4-carboxylate

Systemtic Name: ethyl 1-[3-(4-chloranyl-2-methyl-phenoxy)propyl]piperidin-1-ium-4-carboxylate Openeye Name: ethyl 1-[3-(4-chloro-2-methyl-phenoxy)propyl]piperidin-1-ium-4-carboxylate CAS Name: 1-[3-(4-chloro-2-methylphenoxy)propyl]-4-piperidin-1-iumcarboxylic acid ethyl ester IUPAC Name: ethyl 1-[3-(4-chloro-2-methylphenoxy)propyl]piperidin-1-ium-4-carboxylate Traditional Name: 1-[3-(4-chloro-2-methyl-phenoxy)propyl]piperidin-1-ium-4-carboxylic acid ethyl ester Formula: C18H27ClNO3+ MolecularWeight: 340.86488

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CC[NH+](CC1)CCCOC2=C(C=C(C=C2)Cl)C

Isomeric SMILES

CCOC(=O)C1CC[NH+](CC1)CCCOC2=C(C=C(C=C2)Cl)C

InChI

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