2-(1-methylpiperidin-1-ium-1-yl)ethyl 4-azanyl-5-chloranyl-2-methoxy-benzoate

Systemtic Name: 2-(1-methylpiperidin-1-ium-1-yl)ethyl 4-azanyl-5-chloranyl-2-methoxy-benzoate Openeye Name: 2-(1-methylpiperidin-1-ium-1-yl)ethyl 4-amino-5-chloro-2-methoxy-benzoate CAS Name: 4-amino-5-chloro-2-methoxybenzoic acid 2-(1-methyl-1-piperidin-1-iumyl)ethyl ester IUPAC Name: 2-(1-methylpiperidin-1-ium-1-yl)ethyl 4-amino-5-chloro-2-methoxybenzoate Traditional Name: 4-amino-5-chloro-2-methoxy-benzoic acid 2-(1-methylpiperidin-1-ium-1-yl)ethyl ester Formula: C16H24ClN2O3+ MolecularWeight: 327.82636

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCCCC1)CCOC(=O)C2=CC(=C(C=C2OC)N)Cl

Isomeric SMILES

C[N+]1(CCCCC1)CCOC(=O)C2=CC(=C(C=C2OC)N)Cl

InChI

InChI=1S/C16H23ClN2O3/c1-19(6-4-3-5-7-19)8-9-22-16(20)12-10-13(17)14(18)11-15(12)21-2/h10-11H,3-9H2,1-2H3,(H-,18,20)/p+1