2-[(2E)-2-[4-(1,3-benzodioxol-5-yl)butan-2-ylidene]hydrazinyl]-6-methyl-1H-pyrimidin-4-one

Systemtic Name: 2-[(2E)-2-[4-(1,3-benzodioxol-5-yl)butan-2-ylidene]hydrazinyl]-6-methyl-1H-pyrimidin-4-one Openeye Name: 2-[(2E)-2-[3-(1,3-benzodioxol-5-yl)-1-methyl-propylidene]hydrazino]-6-methyl-1H-pyrimidin-4-one CAS Name: 2-[(2E)-2-[4-(1,3-benzodioxol-5-yl)butan-2-ylidene]hydrazinyl]-6-methyl-1H-pyrimidin-4-one IUPAC Name: 2-[(2E)-2-[4-(1,3-benzodioxol-5-yl)butan-2-ylidene]hydrazinyl]-6-methyl-1H-pyrimidin-4-one Traditional Name: 2-[(N'E)-N'-[3-(1,3-benzodioxol-5-yl)-1-methyl-propylidene]hydrazino]-6-methyl-1H-pyrimidin-4-one Formula: C16H18N4O3 MolecularWeight: 314.33912

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N=C(N1)NN=C(C)CCC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CC1=CC(=O)N=C(N1)N/N=C(\C)/CCC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C16H18N4O3/c1-10(19-20-16-17-11(2)7-15(21)18-16)3-4-12-5-6-13-14(8-12)23-9-22-13/h5-8H,3-4,9H2,1-2H3,(H2,17,18,20,21)/b19-10+