methyl 1-[2-[(4-bromanyl-3,5-dimethoxy-phenyl)carbonylamino]cyclohexyl]-1,2,3-triazole-4-carboxylate

Systemtic Name: methyl 1-[2-[(4-bromanyl-3,5-dimethoxy-phenyl)carbonylamino]cyclohexyl]-1,2,3-triazole-4-carboxylate Openeye Name: methyl 1-[2-[(4-bromo-3,5-dimethoxy-benzoyl)amino]cyclohexyl]triazole-4-carboxylate CAS Name: 1-[2-[[(4-bromo-3,5-dimethoxyphenyl)-oxomethyl]amino]cyclohexyl]-4-triazolecarboxylic acid methyl ester IUPAC Name: methyl 1-[2-[(4-bromo-3,5-dimethoxybenzoyl)amino]cyclohexyl]triazole-4-carboxylate Traditional Name: 1-[2-[(4-bromo-3,5-dimethoxy-benzoyl)amino]cyclohexyl]triazole-4-carboxylic acid methyl ester Formula: C19H23BrN4O5 MolecularWeight: 467.31372

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1Br)OC)C(=O)NC2CCCCC2N3C=C(N=N3)C(=O)OC

Isomeric SMILES

COC1=CC(=CC(=C1Br)OC)C(=O)NC2CCCCC2N3C=C(N=N3)C(=O)OC

InChI

InChI=1S/C19H23BrN4O5/c1-27-15-8-11(9-16(28-2)17(15)20)18(25)21-12-6-4-5-7-14(12)24-10-13(22-23-24)19(26)29-3/h8-10,12,14H,4-7H2,1-3H3,(H,21,25)