2-[4-[(E)-N'-phenylmethoxycarbonylcarbamimidoyl]phenyl]pyrimidine-5-carboxylic acid

Systemtic Name: 2-[4-[(E)-N'-phenylmethoxycarbonylcarbamimidoyl]phenyl]pyrimidine-5-carboxylic acid Openeye Name: 2-[4-[(E)-N'-benzyloxycarbonylcarbamimidoyl]phenyl]pyrimidine-5-carboxylic acid CAS Name: 2-[4-[(E)-amino(phenylmethoxycarbonylimino)methyl]phenyl]-5-pyrimidinecarboxylic acid IUPAC Name: 2-[4-[(E)-N'-phenylmethoxycarbonylcarbamimidoyl]phenyl]pyrimidine-5-carboxylic acid Traditional Name: 2-[4-[(E)-N'-carbobenzoxyamidino]phenyl]pyrimidine-5-carboxylic acid Formula: C20H16N4O4 MolecularWeight: 376.36544

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)N=C(C2=CC=C(C=C2)C3=NC=C(C=N3)C(=O)O)N

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)/N=C(\C2=CC=C(C=C2)C3=NC=C(C=N3)C(=O)O)/N

InChI

InChI=1S/C20H16N4O4/c21-17(24-20(27)28-12-13-4-2-1-3-5-13)14-6-8-15(9-7-14)18-22-10-16(11-23-18)19(25)26/h1-11H,12H2,(H,25,26)(H2,21,24,27)