2-[(2-piperidin-1-ium-1-ylethanoylamino)carbamoyl]benzoate

Systemtic Name: 2-[(2-piperidin-1-ium-1-ylethanoylamino)carbamoyl]benzoate Openeye Name: 2-[[(2-piperidin-1-ium-1-ylacetyl)amino]carbamoyl]benzoate CAS Name: 2-[oxo-[[1-oxo-2-(1-piperidin-1-iumyl)ethyl]hydrazo]methyl]benzoate IUPAC Name: 2-[[(2-piperidin-1-ium-1-ylacetyl)amino]carbamoyl]benzoate Traditional Name: 2-[[(2-piperidin-1-ium-1-ylacetyl)amino]carbamoyl]benzoate Formula: C15H19N3O4 MolecularWeight: 305.32906

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CC(=O)NNC(=O)C2=CC=CC=C2C(=O)[O-]

Isomeric SMILES

C1CC[NH+](CC1)CC(=O)NNC(=O)C2=CC=CC=C2C(=O)[O-]

InChI

InChI=1S/C15H19N3O4/c19-13(10-18-8-4-1-5-9-18)16-17-14(20)11-6-2-3-7-12(11)15(21)22/h2-3,6-7H,1,4-5,8-10H2,(H,16,19)(H,17,20)(H,21,22)