3-(1,4,5,6-tetrahydropyrimidin-2-ylamino)benzoic acid

Systemtic Name: 3-(1,4,5,6-tetrahydropyrimidin-2-ylamino)benzoic acid Openeye Name: 3-(1,4,5,6-tetrahydropyrimidin-2-ylamino)benzoic acid CAS Name: 3-(1,4,5,6-tetrahydropyrimidin-2-ylamino)benzoic acid IUPAC Name: 3-(1,4,5,6-tetrahydropyrimidin-2-ylamino)benzoic acid Traditional Name: 3-(1,4,5,6-tetrahydropyrimidin-2-ylamino)benzoic acid Formula: C11H13N3O2 MolecularWeight: 219.23982

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Descriptors Computed from Structure

Canonical SMILES:

C1CNC(=NC1)NC2=CC=CC(=C2)C(=O)O

Isomeric SMILES

C1CNC(=NC1)NC2=CC=CC(=C2)C(=O)O

InChI

InChI=1S/C11H13N3O2/c15-10(16)8-3-1-4-9(7-8)14-11-12-5-2-6-13-11/h1,3-4,7H,2,5-6H2,(H,15,16)(H2,12,13,14)