methyl 1-[2-(2,4-dimethylphenyl)ethanoylamino]cycloheptane-1-carboxylate

Systemtic Name: methyl 1-[2-(2,4-dimethylphenyl)ethanoylamino]cycloheptane-1-carboxylate Openeye Name: methyl 1-[[2-(2,4-dimethylphenyl)acetyl]amino]cycloheptanecarboxylate CAS Name: 1-[[2-(2,4-dimethylphenyl)-1-oxoethyl]amino]-1-cycloheptanecarboxylic acid methyl ester IUPAC Name: methyl 1-[[2-(2,4-dimethylphenyl)acetyl]amino]cycloheptane-1-carboxylate Traditional Name: 1-[[2-(2,4-dimethylphenyl)acetyl]amino]cycloheptanecarboxylic acid methyl ester Formula: C19H27NO3 MolecularWeight: 317.42258

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)CC(=O)NC2(CCCCCC2)C(=O)OC)C

Isomeric SMILES

CC1=CC(=C(C=C1)CC(=O)NC2(CCCCCC2)C(=O)OC)C

InChI

InChI=1S/C19H27NO3/c1-14-8-9-16(15(2)12-14)13-17(21)20-19(18(22)23-3)10-6-4-5-7-11-19/h8-9,12H,4-7,10-11,13H2,1-3H3,(H,20,21)