[2-[4-(3-methylbutanoylamino)phenyl]-2-oxidanylidene-ethyl] 3,5-dimethoxy-4-methyl-benzoate

Systemtic Name: [2-[4-(3-methylbutanoylamino)phenyl]-2-oxidanylidene-ethyl] 3,5-dimethoxy-4-methyl-benzoate Openeye Name: [2-[4-(3-methylbutanoylamino)phenyl]-2-oxo-ethyl] 3,5-dimethoxy-4-methyl-benzoate CAS Name: 3,5-dimethoxy-4-methylbenzoic acid [2-[4-[(3-methyl-1-oxobutyl)amino]phenyl]-2-oxoethyl] ester IUPAC Name: [2-[4-(3-methylbutanoylamino)phenyl]-2-oxoethyl] 3,5-dimethoxy-4-methylbenzoate Traditional Name: 3,5-dimethoxy-4-methyl-benzoic acid [2-[4-(isovalerylamino)phenyl]-2-keto-ethyl] ester Formula: C23H27NO6 MolecularWeight: 413.46358

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1OC)C(=O)OCC(=O)C2=CC=C(C=C2)NC(=O)CC(C)C)OC

Isomeric SMILES

CC1=C(C=C(C=C1OC)C(=O)OCC(=O)C2=CC=C(C=C2)NC(=O)CC(C)C)OC

InChI

InChI=1S/C23H27NO6/c1-14(2)10-22(26)24-18-8-6-16(7-9-18)19(25)13-30-23(27)17-11-20(28-4)15(3)21(12-17)29-5/h6-9,11-12,14H,10,13H2,1-5H3,(H,24,26)