4-azanyl-2-[6-(carboxymethyloxy)naphthalen-2-yl]pyrimidine-5-carboxylic acid

Systemtic Name: 4-azanyl-2-[6-(carboxymethyloxy)naphthalen-2-yl]pyrimidine-5-carboxylic acid Openeye Name: 4-amino-2-[6-(carboxymethyloxy)-2-naphthyl]pyrimidine-5-carboxylic acid CAS Name: 4-amino-2-[6-(carboxymethyloxy)-2-naphthalenyl]-5-pyrimidinecarboxylic acid IUPAC Name: 4-amino-2-[6-(carboxymethyloxy)naphthalen-2-yl]pyrimidine-5-carboxylic acid Traditional Name: 4-amino-2-[6-(carboxymethyloxy)-2-naphthyl]pyrimidine-5-carboxylic acid Formula: C17H13N3O5 MolecularWeight: 339.30222

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CC(=C2)OCC(=O)O)C=C1C3=NC=C(C(=N3)N)C(=O)O

Isomeric SMILES

C1=CC2=C(C=CC(=C2)OCC(=O)O)C=C1C3=NC=C(C(=N3)N)C(=O)O

InChI

InChI=1S/C17H13N3O5/c18-15-13(17(23)24)7-19-16(20-15)11-2-1-10-6-12(25-8-14(21)22)4-3-9(10)5-11/h1-7H,8H2,(H,21,22)(H,23,24)(H2,18,19,20)