3-azanyl-3-[2-[(3-chlorophenyl)amino]pyrimidin-5-yl]propanoic acid

Systemtic Name: 3-azanyl-3-[2-[(3-chlorophenyl)amino]pyrimidin-5-yl]propanoic acid Openeye Name: 3-amino-3-[2-(3-chloroanilino)pyrimidin-5-yl]propanoic acid CAS Name: 3-amino-3-[2-(3-chloroanilino)-5-pyrimidinyl]propanoic acid IUPAC Name: 3-amino-3-[2-(3-chloroanilino)pyrimidin-5-yl]propanoic acid Traditional Name: 3-amino-3-[2-(3-chloroanilino)pyrimidin-5-yl]propionic acid Formula: C13H13ClN4O2 MolecularWeight: 292.72092

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Cl)NC2=NC=C(C=N2)C(CC(=O)O)N

Isomeric SMILES

C1=CC(=CC(=C1)Cl)NC2=NC=C(C=N2)C(CC(=O)O)N

InChI

InChI=1S/C13H13ClN4O2/c14-9-2-1-3-10(4-9)18-13-16-6-8(7-17-13)11(15)5-12(19)20/h1-4,6-7,11H,5,15H2,(H,19,20)(H,16,17,18)