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

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

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC1=CC(=C(C=C1)OC)OC)CC(=O)NCC2=CC=C(C=C2)C(=O)OC

Isomeric SMILES

CN(CCC1=CC(=C(C=C1)OC)OC)CC(=O)NCC2=CC=C(C=C2)C(=O)OC

InChI

InChI=1S/C22H28N2O5/c1-24(12-11-16-7-10-19(27-2)20(13-16)28-3)15-21(25)23-14-17-5-8-18(9-6-17)22(26)29-4/h5-10,13H,11-12,14-15H2,1-4H3,(H,23,25)