3-[[2-(cyclopropylamino)-2-oxidanylidene-ethyl]carbamoyl]benzoic acid

Systemtic Name: 3-[[2-(cyclopropylamino)-2-oxidanylidene-ethyl]carbamoyl]benzoic acid Openeye Name: 3-[[2-(cyclopropylamino)-2-oxo-ethyl]carbamoyl]benzoic acid CAS Name: 3-[[[2-(cyclopropylamino)-2-oxoethyl]amino]-oxomethyl]benzoic acid IUPAC Name: 3-[[2-(cyclopropylamino)-2-oxoethyl]carbamoyl]benzoic acid Traditional Name: 3-[[2-(cyclopropylamino)-2-keto-ethyl]carbamoyl]benzoic acid Formula: C13H14N2O4 MolecularWeight: 262.26126

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)CNC(=O)C2=CC(=CC=C2)C(=O)O

Isomeric SMILES

C1CC1NC(=O)CNC(=O)C2=CC(=CC=C2)C(=O)O

InChI

InChI=1S/C13H14N2O4/c16-11(15-10-4-5-10)7-14-12(17)8-2-1-3-9(6-8)13(18)19/h1-3,6,10H,4-5,7H2,(H,14,17)(H,15,16)(H,18,19)