methyl 6-[di(propan-2-yl)amino]-2-methyl-7-oxidanylidene-cyclohepta-1,3,5-triene-1-carboxylate

Systemtic Name: methyl 6-[di(propan-2-yl)amino]-2-methyl-7-oxidanylidene-cyclohepta-1,3,5-triene-1-carboxylate Openeye Name: methyl 6-(diisopropylamino)-2-methyl-7-oxo-cyclohepta-1,3,5-triene-1-carboxylate CAS Name: 6-[di(propan-2-yl)amino]-2-methyl-7-oxo-1-cyclohepta-1,3,5-trienecarboxylic acid methyl ester IUPAC Name: methyl 6-[di(propan-2-yl)amino]-2-methyl-7-oxocyclohepta-1,3,5-triene-1-carboxylate Traditional Name: 6-(diisopropylamino)-7-keto-2-methyl-cyclohepta-1,3,5-triene-1-carboxylic acid methyl ester Formula: C16H23NO3 MolecularWeight: 277.35872

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)C(=CC=C1)N(C(C)C)C(C)C)C(=O)OC

Isomeric SMILES

CC1=C(C(=O)C(=CC=C1)N(C(C)C)C(C)C)C(=O)OC

InChI

InChI=1S/C16H23NO3/c1-10(2)17(11(3)4)13-9-7-8-12(5)14(15(13)18)16(19)20-6/h7-11H,1-6H3