4-[2-[6-azanyl-1-cyclopropyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-2-oxidanylidene-ethoxy]-3-methoxy-benzenecarbonitrile

Systemtic Name: 4-[2-[6-azanyl-1-cyclopropyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-2-oxidanylidene-ethoxy]-3-methoxy-benzenecarbonitrile Openeye Name: 4-[2-(6-amino-1-cyclopropyl-2,4-dioxo-pyrimidin-5-yl)-2-oxo-ethoxy]-3-methoxy-benzonitrile CAS Name: 4-[2-(6-amino-1-cyclopropyl-2,4-dioxo-5-pyrimidinyl)-2-oxoethoxy]-3-methoxybenzonitrile IUPAC Name: 4-[2-(6-amino-1-cyclopropyl-2,4-dioxopyrimidin-5-yl)-2-oxoethoxy]-3-methoxybenzonitrile Traditional Name: 4-[2-(6-amino-1-cyclopropyl-2,4-diketo-pyrimidin-5-yl)-2-keto-ethoxy]-3-methoxy-benzonitrile Formula: C17H16N4O5 MolecularWeight: 356.33274

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C#N)OCC(=O)C2=C(N(C(=O)NC2=O)C3CC3)N

Isomeric SMILES

COC1=C(C=CC(=C1)C#N)OCC(=O)C2=C(N(C(=O)NC2=O)C3CC3)N

InChI

InChI=1S/C17H16N4O5/c1-25-13-6-9(7-18)2-5-12(13)26-8-11(22)14-15(19)21(10-3-4-10)17(24)20-16(14)23/h2,5-6,10H,3-4,8,19H2,1H3,(H,20,23,24)