methyl 1-[3-(3-bromanyl-4-methoxy-phenyl)propanoylamino]cyclohexane-1-carboxylate

Systemtic Name: methyl 1-[3-(3-bromanyl-4-methoxy-phenyl)propanoylamino]cyclohexane-1-carboxylate Openeye Name: methyl 1-[3-(3-bromo-4-methoxy-phenyl)propanoylamino]cyclohexanecarboxylate CAS Name: 1-[[3-(3-bromo-4-methoxyphenyl)-1-oxopropyl]amino]-1-cyclohexanecarboxylic acid methyl ester IUPAC Name: methyl 1-[3-(3-bromo-4-methoxyphenyl)propanoylamino]cyclohexane-1-carboxylate Traditional Name: 1-[3-(3-bromo-4-methoxy-phenyl)propanoylamino]cyclohexanecarboxylic acid methyl ester Formula: C18H24BrNO4 MolecularWeight: 398.29146

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCC(=O)NC2(CCCCC2)C(=O)OC)Br

Isomeric SMILES

COC1=C(C=C(C=C1)CCC(=O)NC2(CCCCC2)C(=O)OC)Br

InChI

InChI=1S/C18H24BrNO4/c1-23-15-8-6-13(12-14(15)19)7-9-16(21)20-18(17(22)24-2)10-4-3-5-11-18/h6,8,12H,3-5,7,9-11H2,1-2H3,(H,20,21)