2-[4-[4-azanylbutanoyl(ethanoyl)amino]phenyl]-6-oxidanylidene-1H-pyrimidine-5-carboxylic acid

Systemtic Name: 2-[4-[4-azanylbutanoyl(ethanoyl)amino]phenyl]-6-oxidanylidene-1H-pyrimidine-5-carboxylic acid Openeye Name: 2-[4-[acetyl(4-aminobutanoyl)amino]phenyl]-6-oxo-1H-pyrimidine-5-carboxylic acid CAS Name: 2-[4-[acetyl-(4-amino-1-oxobutyl)amino]phenyl]-6-oxo-1H-pyrimidine-5-carboxylic acid IUPAC Name: 2-[4-[acetyl(4-aminobutanoyl)amino]phenyl]-6-oxo-1H-pyrimidine-5-carboxylic acid Traditional Name: 2-[4-[acetyl(4-aminobutanoyl)amino]phenyl]-6-keto-1H-pyrimidine-5-carboxylic acid Formula: C17H18N4O5 MolecularWeight: 358.34862

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N(C1=CC=C(C=C1)C2=NC=C(C(=O)N2)C(=O)O)C(=O)CCCN

Isomeric SMILES

CC(=O)N(C1=CC=C(C=C1)C2=NC=C(C(=O)N2)C(=O)O)C(=O)CCCN

InChI

InChI=1S/C17H18N4O5/c1-10(22)21(14(23)3-2-8-18)12-6-4-11(5-7-12)15-19-9-13(17(25)26)16(24)20-15/h4-7,9H,2-3,8,18H2,1H3,(H,25,26)(H,19,20,24)