6-(1,3-benzodioxol-5-yl)-2-[(3-methoxyphenyl)amino]-1H-pyrimidin-4-one

Systemtic Name: 6-(1,3-benzodioxol-5-yl)-2-[(3-methoxyphenyl)amino]-1H-pyrimidin-4-one Openeye Name: 6-(1,3-benzodioxol-5-yl)-2-(3-methoxyanilino)-1H-pyrimidin-4-one CAS Name: 6-(1,3-benzodioxol-5-yl)-2-(3-methoxyanilino)-1H-pyrimidin-4-one IUPAC Name: 6-(1,3-benzodioxol-5-yl)-2-(3-methoxyanilino)-1H-pyrimidin-4-one Traditional Name: 6-(1,3-benzodioxol-5-yl)-2-(m-anisidino)-1H-pyrimidin-4-one Formula: C18H15N3O4 MolecularWeight: 337.3294

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC2=NC(=O)C=C(N2)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

COC1=CC=CC(=C1)NC2=NC(=O)C=C(N2)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C18H15N3O4/c1-23-13-4-2-3-12(8-13)19-18-20-14(9-17(22)21-18)11-5-6-15-16(7-11)25-10-24-15/h2-9H,10H2,1H3,(H2,19,20,21,22)