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

Systemtic Name: (2R)-2-[[4-[4-[2-(3,4-dimethoxyphenyl)ethanoylamino]phenyl]phenyl]carbonylamino]-3-methyl-butanoic acid Openeye Name: (2R)-2-[[4-[4-[[2-(3,4-dimethoxyphenyl)acetyl]amino]phenyl]benzoyl]amino]-3-methyl-butanoic acid CAS Name: (2R)-2-[[[4-[4-[[2-(3,4-dimethoxyphenyl)-1-oxoethyl]amino]phenyl]phenyl]-oxomethyl]amino]-3-methylbutanoic acid IUPAC Name: (2R)-2-[[4-[4-[[2-(3,4-dimethoxyphenyl)acetyl]amino]phenyl]benzoyl]amino]-3-methylbutanoic acid Traditional Name: (2R)-2-[[4-[4-(homoveratroylamino)phenyl]benzoyl]amino]-3-methyl-butyric acid Formula: C28H30N2O6 MolecularWeight: 490.5476

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)O)NC(=O)C1=CC=C(C=C1)C2=CC=C(C=C2)NC(=O)CC3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CC(C)[C@H](C(=O)O)NC(=O)C1=CC=C(C=C1)C2=CC=C(C=C2)NC(=O)CC3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C28H30N2O6/c1-17(2)26(28(33)34)30-27(32)21-8-6-19(7-9-21)20-10-12-22(13-11-20)29-25(31)16-18-5-14-23(35-3)24(15-18)36-4/h5-15,17,26H,16H2,1-4H3,(H,29,31)(H,30,32)(H,33,34)/t26-/m1/s1