methyl 3-[2-[2-(3,4-dimethoxyphenyl)ethyl-methyl-amino]ethanoylamino]-4-methyl-benzoate

Systemtic Name: methyl 3-[2-[2-(3,4-dimethoxyphenyl)ethyl-methyl-amino]ethanoylamino]-4-methyl-benzoate Openeye Name: methyl 3-[[2-[2-(3,4-dimethoxyphenyl)ethyl-methyl-amino]acetyl]amino]-4-methyl-benzoate CAS Name: 3-[[2-[2-(3,4-dimethoxyphenyl)ethyl-methylamino]-1-oxoethyl]amino]-4-methylbenzoic acid methyl ester IUPAC Name: methyl 3-[[2-[2-(3,4-dimethoxyphenyl)ethyl-methylamino]acetyl]amino]-4-methylbenzoate Traditional Name: 3-[[2-[homoveratryl(methyl)amino]acetyl]amino]-4-methyl-benzoic acid methyl ester Formula: C22H28N2O5 MolecularWeight: 400.46812

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)CN(C)CCC2=CC(=C(C=C2)OC)OC

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)CN(C)CCC2=CC(=C(C=C2)OC)OC

InChI

InChI=1S/C22H28N2O5/c1-15-6-8-17(22(26)29-5)13-18(15)23-21(25)14-24(2)11-10-16-7-9-19(27-3)20(12-16)28-4/h6-9,12-13H,10-11,14H2,1-5H3,(H,23,25)