2-[2-[2-[(3,4-dimethoxyphenyl)carbonylamino]phenyl]ethanoylamino]-4-methyl-pentanoic acid

Systemtic Name: 2-[2-[2-[(3,4-dimethoxyphenyl)carbonylamino]phenyl]ethanoylamino]-4-methyl-pentanoic acid Openeye Name: 2-[[2-[2-[(3,4-dimethoxybenzoyl)amino]phenyl]acetyl]amino]-4-methyl-pentanoic acid CAS Name: 2-[[2-[2-[[(3,4-dimethoxyphenyl)-oxomethyl]amino]phenyl]-1-oxoethyl]amino]-4-methylpentanoic acid IUPAC Name: 2-[[2-[2-[(3,4-dimethoxybenzoyl)amino]phenyl]acetyl]amino]-4-methylpentanoic acid Traditional Name: 4-methyl-2-[[2-[2-(veratroylamino)phenyl]acetyl]amino]valeric acid Formula: C23H28N2O6 MolecularWeight: 428.47822

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)O)NC(=O)CC1=CC=CC=C1NC(=O)C2=CC(=C(C=C2)OC)OC

Isomeric SMILES

CC(C)CC(C(=O)O)NC(=O)CC1=CC=CC=C1NC(=O)C2=CC(=C(C=C2)OC)OC

InChI

InChI=1S/C23H28N2O6/c1-14(2)11-18(23(28)29)24-21(26)13-15-7-5-6-8-17(15)25-22(27)16-9-10-19(30-3)20(12-16)31-4/h5-10,12,14,18H,11,13H2,1-4H3,(H,24,26)(H,25,27)(H,28,29)