methyl 4,5-dimethoxy-2-[4-(3-methylphenoxy)butanoylamino]benzoate

Systemtic Name: methyl 4,5-dimethoxy-2-[4-(3-methylphenoxy)butanoylamino]benzoate Openeye Name: methyl 4,5-dimethoxy-2-[4-(3-methylphenoxy)butanoylamino]benzoate CAS Name: 4,5-dimethoxy-2-[[4-(3-methylphenoxy)-1-oxobutyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4,5-dimethoxy-2-[4-(3-methylphenoxy)butanoylamino]benzoate Traditional Name: 4,5-dimethoxy-2-[4-(3-methylphenoxy)butanoylamino]benzoic acid methyl ester Formula: C21H25NO6 MolecularWeight: 387.4263

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCCCC(=O)NC2=CC(=C(C=C2C(=O)OC)OC)OC

Isomeric SMILES

CC1=CC(=CC=C1)OCCCC(=O)NC2=CC(=C(C=C2C(=O)OC)OC)OC

InChI

InChI=1S/C21H25NO6/c1-14-7-5-8-15(11-14)28-10-6-9-20(23)22-17-13-19(26-3)18(25-2)12-16(17)21(24)27-4/h5,7-8,11-13H,6,9-10H2,1-4H3,(H,22,23)