methyl 3-[methyl-[[(2R)-1-methylpiperidin-1-ium-2-yl]methyl]carbamoyl]benzoate

Systemtic Name: methyl 3-[methyl-[[(2R)-1-methylpiperidin-1-ium-2-yl]methyl]carbamoyl]benzoate Openeye Name: methyl 3-[methyl-[[(2R)-1-methylpiperidin-1-ium-2-yl]methyl]carbamoyl]benzoate CAS Name: 3-[[methyl-[[(2R)-1-methyl-2-piperidin-1-iumyl]methyl]amino]-oxomethyl]benzoic acid methyl ester IUPAC Name: methyl 3-[methyl-[[(2R)-1-methylpiperidin-1-ium-2-yl]methyl]carbamoyl]benzoate Traditional Name: 3-[methyl-[[(2R)-1-methylpiperidin-1-ium-2-yl]methyl]carbamoyl]benzoic acid methyl ester Formula: C17H25N2O3+ MolecularWeight: 305.392

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCCCC1CN(C)C(=O)C2=CC(=CC=C2)C(=O)OC

Isomeric SMILES

C[NH+]1CCCC[C@@H]1CN(C)C(=O)C2=CC(=CC=C2)C(=O)OC

InChI

InChI=1S/C17H24N2O3/c1-18-10-5-4-9-15(18)12-19(2)16(20)13-7-6-8-14(11-13)17(21)22-3/h6-8,11,15H,4-5,9-10,12H2,1-3H3/p+1/t15-/m1/s1