2-[[4-[2-[[1-(4-hydroxyphenyl)-1-oxidanyl-propan-2-yl]amino]ethyl]phenyl]amino]-2-methyl-propanoic acid

Systemtic Name: 2-[[4-[2-[[1-(4-hydroxyphenyl)-1-oxidanyl-propan-2-yl]amino]ethyl]phenyl]amino]-2-methyl-propanoic acid Openeye Name: 2-[4-[2-[[2-hydroxy-2-(4-hydroxyphenyl)-1-methyl-ethyl]amino]ethyl]anilino]-2-methyl-propanoic acid CAS Name: 2-[4-[2-[[1-hydroxy-1-(4-hydroxyphenyl)propan-2-yl]amino]ethyl]anilino]-2-methylpropanoic acid IUPAC Name: 2-[4-[2-[[1-hydroxy-1-(4-hydroxyphenyl)propan-2-yl]amino]ethyl]anilino]-2-methylpropanoic acid Traditional Name: 2-[4-[2-[[2-hydroxy-2-(4-hydroxyphenyl)-1-methyl-ethyl]amino]ethyl]anilino]-2-methyl-propionic acid Formula: C21H28N2O4 MolecularWeight: 372.45802

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C1=CC=C(C=C1)O)O)NCCC2=CC=C(C=C2)NC(C)(C)C(=O)O

Isomeric SMILES

CC(C(C1=CC=C(C=C1)O)O)NCCC2=CC=C(C=C2)NC(C)(C)C(=O)O

InChI

InChI=1S/C21H28N2O4/c1-14(19(25)16-6-10-18(24)11-7-16)22-13-12-15-4-8-17(9-5-15)23-21(2,3)20(26)27/h4-11,14,19,22-25H,12-13H2,1-3H3,(H,26,27)