4-(4-azanyl-2-oxidanylidene-pyrimidin-1-yl)-2,2-bis(methoxymethyl)-3-oxidanyl-3,4-dihydrochromene-6-carbonitrile

Systemtic Name: 4-(4-azanyl-2-oxidanylidene-pyrimidin-1-yl)-2,2-bis(methoxymethyl)-3-oxidanyl-3,4-dihydrochromene-6-carbonitrile Openeye Name: 4-(4-amino-2-oxo-pyrimidin-1-yl)-3-hydroxy-2,2-bis(methoxymethyl)chromane-6-carbonitrile CAS Name: 4-(4-amino-2-oxo-1-pyrimidinyl)-3-hydroxy-2,2-bis(methoxymethyl)-3,4-dihydro-2H-1-benzopyran-6-carbonitrile IUPAC Name: 4-(4-amino-2-oxopyrimidin-1-yl)-3-hydroxy-2,2-bis(methoxymethyl)-3,4-dihydrochromene-6-carbonitrile Traditional Name: 4-(4-amino-2-keto-pyrimidin-1-yl)-3-hydroxy-2,2-bis(methoxymethyl)chroman-6-carbonitrile Formula: C18H20N4O5 MolecularWeight: 372.3752

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Descriptors Computed from Structure

Canonical SMILES:

COCC1(C(C(C2=C(O1)C=CC(=C2)C#N)N3C=CC(=NC3=O)N)O)COC

Isomeric SMILES

COCC1(C(C(C2=C(O1)C=CC(=C2)C#N)N3C=CC(=NC3=O)N)O)COC

InChI

InChI=1S/C18H20N4O5/c1-25-9-18(10-26-2)16(23)15(22-6-5-14(20)21-17(22)24)12-7-11(8-19)3-4-13(12)27-18/h3-7,15-16,23H,9-10H2,1-2H3,(H2,20,21,24)