4-[(2-azanylidene-3-methyl-5-oxidanylidene-imidazolidin-1-yl)methyl]benzoic acid

Systemtic Name: 4-[(2-azanylidene-3-methyl-5-oxidanylidene-imidazolidin-1-yl)methyl]benzoic acid Openeye Name: 4-[(2-imino-3-methyl-5-oxo-imidazolidin-1-yl)methyl]benzoic acid CAS Name: 4-[(2-imino-3-methyl-5-oxo-1-imidazolidinyl)methyl]benzoic acid IUPAC Name: 4-[(2-imino-3-methyl-5-oxoimidazolidin-1-yl)methyl]benzoic acid Traditional Name: 4-[(2-imino-5-keto-3-methyl-imidazolidin-1-yl)methyl]benzoic acid Formula: C12H13N3O3 MolecularWeight: 247.24992

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Descriptors Computed from Structure

Canonical SMILES:

CN1CC(=O)N(C1=N)CC2=CC=C(C=C2)C(=O)O

Isomeric SMILES

CN1CC(=O)N(C1=N)CC2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C12H13N3O3/c1-14-7-10(16)15(12(14)13)6-8-2-4-9(5-3-8)11(17)18/h2-5,13H,6-7H2,1H3,(H,17,18)