4-[2-(1,3-benzodioxol-5-yloxy)ethylamino]-1,3-dimethyl-2,6-bis(oxidanylidene)pyrimidine-5-carbonitrile

Systemtic Name: 4-[2-(1,3-benzodioxol-5-yloxy)ethylamino]-1,3-dimethyl-2,6-bis(oxidanylidene)pyrimidine-5-carbonitrile Openeye Name: 4-[2-(1,3-benzodioxol-5-yloxy)ethylamino]-1,3-dimethyl-2,6-dioxo-pyrimidine-5-carbonitrile CAS Name: 4-[2-(1,3-benzodioxol-5-yloxy)ethylamino]-1,3-dimethyl-2,6-dioxo-5-pyrimidinecarbonitrile IUPAC Name: 4-[2-(1,3-benzodioxol-5-yloxy)ethylamino]-1,3-dimethyl-2,6-dioxopyrimidine-5-carbonitrile Traditional Name: 4-[2-(1,3-benzodioxol-5-yloxy)ethylamino]-2,6-diketo-1,3-dimethyl-pyrimidine-5-carbonitrile Formula: C16H16N4O5 MolecularWeight: 344.32204

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C(=O)N(C1=O)C)C#N)NCCOC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CN1C(=C(C(=O)N(C1=O)C)C#N)NCCOC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C16H16N4O5/c1-19-14(11(8-17)15(21)20(2)16(19)22)18-5-6-23-10-3-4-12-13(7-10)25-9-24-12/h3-4,7,18H,5-6,9H2,1-2H3