methyl 4-(4-methyl-5-oxidanylidene-4-propan-2-yl-1H-imidazol-2-yl)-1,3-benzodioxole-5-carboxylate

Systemtic Name: methyl 4-(4-methyl-5-oxidanylidene-4-propan-2-yl-1H-imidazol-2-yl)-1,3-benzodioxole-5-carboxylate Openeye Name: methyl 4-(4-isopropyl-4-methyl-5-oxo-1H-imidazol-2-yl)-1,3-benzodioxole-5-carboxylate CAS Name: 4-(4-methyl-5-oxo-4-propan-2-yl-1H-imidazol-2-yl)-1,3-benzodioxole-5-carboxylic acid methyl ester IUPAC Name: methyl 4-(4-methyl-5-oxo-4-propan-2-yl-1H-imidazol-2-yl)-1,3-benzodioxole-5-carboxylate Traditional Name: 4-(4-isopropyl-5-keto-4-methyl-2-imidazolin-2-yl)-piperonylic acid methyl ester Formula: C16H18N2O5 MolecularWeight: 318.32452

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1(C(=O)NC(=N1)C2=C(C=CC3=C2OCO3)C(=O)OC)C

Isomeric SMILES

CC(C)C1(C(=O)NC(=N1)C2=C(C=CC3=C2OCO3)C(=O)OC)C

InChI

InChI=1S/C16H18N2O5/c1-8(2)16(3)15(20)17-13(18-16)11-9(14(19)21-4)5-6-10-12(11)23-7-22-10/h5-6,8H,7H2,1-4H3,(H,17,18,20)