methyl 3,4,5-trimethoxy-2-(3-methylbutanoylamino)benzoate

Systemtic Name: methyl 3,4,5-trimethoxy-2-(3-methylbutanoylamino)benzoate Openeye Name: methyl 3,4,5-trimethoxy-2-(3-methylbutanoylamino)benzoate CAS Name: 3,4,5-trimethoxy-2-[(3-methyl-1-oxobutyl)amino]benzoic acid methyl ester IUPAC Name: methyl 3,4,5-trimethoxy-2-(3-methylbutanoylamino)benzoate Traditional Name: 2-(isovalerylamino)-3,4,5-trimethoxy-benzoic acid methyl ester Formula: C16H23NO6 MolecularWeight: 325.35692

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)NC1=C(C(=C(C=C1C(=O)OC)OC)OC)OC

Isomeric SMILES

CC(C)CC(=O)NC1=C(C(=C(C=C1C(=O)OC)OC)OC)OC

InChI

InChI=1S/C16H23NO6/c1-9(2)7-12(18)17-13-10(16(19)23-6)8-11(20-3)14(21-4)15(13)22-5/h8-9H,7H2,1-6H3,(H,17,18)