methyl-[5-oxidanylidene-7-(2-propoxyphenyl)-8H-pyrimido[4,5-d]pyrimidin-2-yl]carbamic acid

Systemtic Name: methyl-[5-oxidanylidene-7-(2-propoxyphenyl)-8H-pyrimido[4,5-d]pyrimidin-2-yl]carbamic acid Openeye Name: methyl-[5-oxo-7-(2-propoxyphenyl)-8H-pyrimido[4,5-d]pyrimidin-2-yl]carbamic acid CAS Name: methyl-[5-oxo-7-(2-propoxyphenyl)-8H-pyrimido[4,5-d]pyrimidin-2-yl]carbamic acid IUPAC Name: methyl-[5-oxo-7-(2-propoxyphenyl)-8H-pyrimido[4,5-d]pyrimidin-2-yl]carbamic acid Traditional Name: [5-keto-7-(2-propoxyphenyl)-8H-pyrimido[4,5-d]pyrimidin-2-yl]-methyl-carbamic acid Formula: C17H17N5O4 MolecularWeight: 355.34798

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=CC=C1C2=NC(=O)C3=CN=C(N=C3N2)N(C)C(=O)O

Isomeric SMILES

CCCOC1=CC=CC=C1C2=NC(=O)C3=CN=C(N=C3N2)N(C)C(=O)O

InChI

InChI=1S/C17H17N5O4/c1-3-8-26-12-7-5-4-6-10(12)13-19-14-11(15(23)20-13)9-18-16(21-14)22(2)17(24)25/h4-7,9H,3,8H2,1-2H3,(H,24,25)(H,18,19,20,21,23)