methyl 1-[2-(4-bromanyl-2,6-dimethyl-phenyl)ethanoylamino]-3-methyl-cyclohexane-1-carboxylate

Systemtic Name: methyl 1-[2-(4-bromanyl-2,6-dimethyl-phenyl)ethanoylamino]-3-methyl-cyclohexane-1-carboxylate Openeye Name: methyl 1-[[2-(4-bromo-2,6-dimethyl-phenyl)acetyl]amino]-3-methyl-cyclohexanecarboxylate CAS Name: 1-[[2-(4-bromo-2,6-dimethylphenyl)-1-oxoethyl]amino]-3-methyl-1-cyclohexanecarboxylic acid methyl ester IUPAC Name: methyl 1-[[2-(4-bromo-2,6-dimethylphenyl)acetyl]amino]-3-methylcyclohexane-1-carboxylate Traditional Name: 1-[[2-(4-bromo-2,6-dimethyl-phenyl)acetyl]amino]-3-methyl-cyclohexanecarboxylic acid methyl ester Formula: C19H26BrNO3 MolecularWeight: 396.31864

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(C1)(C(=O)OC)NC(=O)CC2=C(C=C(C=C2C)Br)C

Isomeric SMILES

CC1CCCC(C1)(C(=O)OC)NC(=O)CC2=C(C=C(C=C2C)Br)C

InChI

InChI=1S/C19H26BrNO3/c1-12-6-5-7-19(11-12,18(23)24-4)21-17(22)10-16-13(2)8-15(20)9-14(16)3/h8-9,12H,5-7,10-11H2,1-4H3,(H,21,22)