dimethyl 2-butyl-3-methyl-6-oxidanylidene-cyclohepta[d]imidazole-5,7-dicarboxylate

Systemtic Name: dimethyl 2-butyl-3-methyl-6-oxidanylidene-cyclohepta[d]imidazole-5,7-dicarboxylate Openeye Name: dimethyl 2-butyl-3-methyl-6-oxo-cyclohepta[d]imidazole-5,7-dicarboxylate CAS Name: 2-butyl-3-methyl-6-oxocyclohepta[d]imidazole-5,7-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 2-butyl-3-methyl-6-oxocyclohepta[d]imidazole-5,7-dicarboxylate Traditional Name: 2-butyl-6-keto-3-methyl-cyclohept[d]imidazole-5,7-dicarboxylic acid dimethyl ester Formula: C17H20N2O5 MolecularWeight: 332.3511

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC2=C(N1C)C=C(C(=O)C(=C2)C(=O)OC)C(=O)OC

Isomeric SMILES

CCCCC1=NC2=C(N1C)C=C(C(=O)C(=C2)C(=O)OC)C(=O)OC

InChI

InChI=1S/C17H20N2O5/c1-5-6-7-14-18-12-8-10(16(21)23-3)15(20)11(17(22)24-4)9-13(12)19(14)2/h8-9H,5-7H2,1-4H3