4-(4,5-dihydro-1H-imidazol-2-ylamino)-3-methyl-benzoic acid

Systemtic Name: 4-(4,5-dihydro-1H-imidazol-2-ylamino)-3-methyl-benzoic acid Openeye Name: 4-(4,5-dihydro-1H-imidazol-2-ylamino)-3-methyl-benzoic acid CAS Name: 4-(4,5-dihydro-1H-imidazol-2-ylamino)-3-methylbenzoic acid IUPAC Name: 4-(4,5-dihydro-1H-imidazol-2-ylamino)-3-methylbenzoic acid Traditional Name: 4-(2-imidazolin-2-ylamino)-3-methyl-benzoic acid Formula: C11H13N3O2 MolecularWeight: 219.23982

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)O)NC2=NCCN2

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)O)NC2=NCCN2

InChI

InChI=1S/C11H13N3O2/c1-7-6-8(10(15)16)2-3-9(7)14-11-12-4-5-13-11/h2-3,6H,4-5H2,1H3,(H,15,16)(H2,12,13,14)