methyl 2-[(1-ethylpiperidin-1-ium-4-yl)carbamoylamino]benzoate

Systemtic Name: methyl 2-[(1-ethylpiperidin-1-ium-4-yl)carbamoylamino]benzoate Openeye Name: methyl 2-[(1-ethylpiperidin-1-ium-4-yl)carbamoylamino]benzoate CAS Name: 2-[[[(1-ethyl-4-piperidin-1-iumyl)amino]-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[(1-ethylpiperidin-1-ium-4-yl)carbamoylamino]benzoate Traditional Name: 2-[(1-ethylpiperidin-1-ium-4-yl)carbamoylamino]benzoic acid methyl ester Formula: C16H24N3O3+ MolecularWeight: 306.38006

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCC(CC1)NC(=O)NC2=CC=CC=C2C(=O)OC

Isomeric SMILES

CC[NH+]1CCC(CC1)NC(=O)NC2=CC=CC=C2C(=O)OC

InChI

InChI=1S/C16H23N3O3/c1-3-19-10-8-12(9-11-19)17-16(21)18-14-7-5-4-6-13(14)15(20)22-2/h4-7,12H,3,8-11H2,1-2H3,(H2,17,18,21)/p+1