2-[(4-methoxyphenyl)amino]-6-oxidanylidene-5-[(4-propoxyphenyl)methyl]-1H-pyrimidin-4-olate

Systemtic Name: 2-[(4-methoxyphenyl)amino]-6-oxidanylidene-5-[(4-propoxyphenyl)methyl]-1H-pyrimidin-4-olate Openeye Name: 2-(4-methoxyanilino)-6-oxo-5-[(4-propoxyphenyl)methyl]-1H-pyrimidin-4-olate CAS Name: 2-(4-methoxyanilino)-6-oxo-5-[(4-propoxyphenyl)methyl]-1H-pyrimidin-4-olate IUPAC Name: 2-(4-methoxyanilino)-6-oxo-5-[(4-propoxyphenyl)methyl]-1H-pyrimidin-4-olate Traditional Name: 6-keto-2-(p-anisidino)-5-(4-propoxybenzyl)-1H-pyrimidin-4-olate Formula: C21H22N3O4- MolecularWeight: 380.41708

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)CC2=C(N=C(NC2=O)NC3=CC=C(C=C3)OC)[O-]

Isomeric SMILES

CCCOC1=CC=C(C=C1)CC2=C(N=C(NC2=O)NC3=CC=C(C=C3)OC)[O-]

InChI

InChI=1S/C21H23N3O4/c1-3-12-28-17-8-4-14(5-9-17)13-18-19(25)23-21(24-20(18)26)22-15-6-10-16(27-2)11-7-15/h4-11H,3,12-13H2,1-2H3,(H3,22,23,24,25,26)/p-1