4-[2-(dimethylamino)-1,4,5,6-tetrahydropyrimidin-6-yl]benzoic acid

Systemtic Name: 4-[2-(dimethylamino)-1,4,5,6-tetrahydropyrimidin-6-yl]benzoic acid Openeye Name: 4-[2-(dimethylamino)-1,4,5,6-tetrahydropyrimidin-6-yl]benzoic acid CAS Name: 4-[2-(dimethylamino)-1,4,5,6-tetrahydropyrimidin-6-yl]benzoic acid IUPAC Name: 4-[2-(dimethylamino)-1,4,5,6-tetrahydropyrimidin-6-yl]benzoic acid Traditional Name: 4-[2-(dimethylamino)-1,4,5,6-tetrahydropyrimidin-6-yl]benzoic acid Formula: C13H17N3O2 MolecularWeight: 247.29298

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=NCCC(N1)C2=CC=C(C=C2)C(=O)O

Isomeric SMILES

CN(C)C1=NCCC(N1)C2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C13H17N3O2/c1-16(2)13-14-8-7-11(15-13)9-3-5-10(6-4-9)12(17)18/h3-6,11H,7-8H2,1-2H3,(H,14,15)(H,17,18)