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

Systemtic Name: 3-azanyl-3-[2-[(2-ethoxyphenyl)amino]pyrimidin-5-yl]propanoic acid Openeye Name: 3-amino-3-[2-(2-ethoxyanilino)pyrimidin-5-yl]propanoic acid CAS Name: 3-amino-3-[2-(2-ethoxyanilino)-5-pyrimidinyl]propanoic acid IUPAC Name: 3-amino-3-[2-(2-ethoxyanilino)pyrimidin-5-yl]propanoic acid Traditional Name: 3-amino-3-[2-(o-phenetidino)pyrimidin-5-yl]propionic acid Formula: C15H18N4O3 MolecularWeight: 302.32842

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1NC2=NC=C(C=N2)C(CC(=O)O)N

Isomeric SMILES

CCOC1=CC=CC=C1NC2=NC=C(C=N2)C(CC(=O)O)N

InChI

InChI=1S/C15H18N4O3/c1-2-22-13-6-4-3-5-12(13)19-15-17-8-10(9-18-15)11(16)7-14(20)21/h3-6,8-9,11H,2,7,16H2,1H3,(H,20,21)(H,17,18,19)