2-azanyl-2-[[4-[[2,6-bis(chloranyl)phenyl]methoxy]phenyl]methyl]-3-[(2-methylpropan-2-yl)oxy]-3-oxidanylidene-propanoic acid

Systemtic Name: 2-azanyl-2-[[4-[[2,6-bis(chloranyl)phenyl]methoxy]phenyl]methyl]-3-[(2-methylpropan-2-yl)oxy]-3-oxidanylidene-propanoic acid Openeye Name: 2-amino-3-tert-butoxy-2-[[4-[(2,6-dichlorophenyl)methoxy]phenyl]methyl]-3-oxo-propanoic acid CAS Name: 2-amino-2-[[4-[(2,6-dichlorophenyl)methoxy]phenyl]methyl]-3-[(2-methylpropan-2-yl)oxy]-3-oxopropanoic acid IUPAC Name: 2-amino-2-[[4-[(2,6-dichlorophenyl)methoxy]phenyl]methyl]-3-[(2-methylpropan-2-yl)oxy]-3-oxopropanoic acid Traditional Name: 2-amino-3-tert-butoxy-2-[4-(2,6-dichlorobenzyl)oxybenzyl]-3-keto-propionic acid Formula: C21H23Cl2NO5 MolecularWeight: 440.31702

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C(CC1=CC=C(C=C1)OCC2=C(C=CC=C2Cl)Cl)(C(=O)O)N

Isomeric SMILES

CC(C)(C)OC(=O)C(CC1=CC=C(C=C1)OCC2=C(C=CC=C2Cl)Cl)(C(=O)O)N

InChI

InChI=1S/C21H23Cl2NO5/c1-20(2,3)29-19(27)21(24,18(25)26)11-13-7-9-14(10-8-13)28-12-15-16(22)5-4-6-17(15)23/h4-10H,11-12,24H2,1-3H3,(H,25,26)