methyl 4-[[2-[(3,4,5-trimethoxyphenyl)carbonylamino]ethanoylamino]methyl]benzoate

Systemtic Name: methyl 4-[[2-[(3,4,5-trimethoxyphenyl)carbonylamino]ethanoylamino]methyl]benzoate Openeye Name: methyl 4-[[[2-[(3,4,5-trimethoxybenzoyl)amino]acetyl]amino]methyl]benzoate CAS Name: 4-[[[1-oxo-2-[[oxo-(3,4,5-trimethoxyphenyl)methyl]amino]ethyl]amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[[2-[(3,4,5-trimethoxybenzoyl)amino]acetyl]amino]methyl]benzoate Traditional Name: 4-[[[2-[(3,4,5-trimethoxybenzoyl)amino]acetyl]amino]methyl]benzoic acid methyl ester Formula: C21H24N2O7 MolecularWeight: 416.42446

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(=O)NCC(=O)NCC2=CC=C(C=C2)C(=O)OC

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(=O)NCC(=O)NCC2=CC=C(C=C2)C(=O)OC

InChI

InChI=1S/C21H24N2O7/c1-27-16-9-15(10-17(28-2)19(16)29-3)20(25)23-12-18(24)22-11-13-5-7-14(8-6-13)21(26)30-4/h5-10H,11-12H2,1-4H3,(H,22,24)(H,23,25)