methyl (1R)-5-(C-ethyl-N-phenethyl-carbonimidoyl)-2,2-dimethyl-4,6-bis(oxidanylidene)cyclohexane-1-carboxylate

Systemtic Name: methyl (1R)-5-(C-ethyl-N-phenethyl-carbonimidoyl)-2,2-dimethyl-4,6-bis(oxidanylidene)cyclohexane-1-carboxylate Openeye Name: methyl (1R)-5-(C-ethyl-N-phenethyl-carbonimidoyl)-2,2-dimethyl-4,6-dioxo-cyclohexanecarboxylate CAS Name: (1R)-2,2-dimethyl-4,6-dioxo-5-(1-phenethyliminopropyl)-1-cyclohexanecarboxylic acid methyl ester IUPAC Name: methyl (1R)-5-(C-ethyl-N-phenethylcarbonimidoyl)-2,2-dimethyl-4,6-dioxocyclohexane-1-carboxylate Traditional Name: (1R)-5-(C-ethyl-N-phenethyl-carbonimidoyl)-4,6-diketo-2,2-dimethyl-cyclohexanecarboxylic acid methyl ester Formula: C21H27NO4 MolecularWeight: 357.44338

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=NCCC1=CC=CC=C1)C2C(=O)CC(C(C2=O)C(=O)OC)(C)C

Isomeric SMILES

CCC(=NCCC1=CC=CC=C1)C2C(=O)CC([C@H](C2=O)C(=O)OC)(C)C

InChI

InChI=1S/C21H27NO4/c1-5-15(22-12-11-14-9-7-6-8-10-14)17-16(23)13-21(2,3)18(19(17)24)20(25)26-4/h6-10,17-18H,5,11-13H2,1-4H3/t17?,18-/m1/s1