2-azanyl-3-[4-(4-oxidanylphenoxy)-2-propan-2-yl-phenyl]propanoic acid

Systemtic Name: 2-azanyl-3-[4-(4-oxidanylphenoxy)-2-propan-2-yl-phenyl]propanoic acid Openeye Name: 2-amino-3-[4-(4-hydroxyphenoxy)-2-isopropyl-phenyl]propanoic acid CAS Name: 2-amino-3-[4-(4-hydroxyphenoxy)-2-propan-2-ylphenyl]propanoic acid IUPAC Name: 2-amino-3-[4-(4-hydroxyphenoxy)-2-propan-2-ylphenyl]propanoic acid Traditional Name: 2-amino-3-[4-(4-hydroxyphenoxy)-2-isopropyl-phenyl]propionic acid Formula: C18H21NO4 MolecularWeight: 315.36364

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C=CC(=C1)OC2=CC=C(C=C2)O)CC(C(=O)O)N

Isomeric SMILES

CC(C)C1=C(C=CC(=C1)OC2=CC=C(C=C2)O)CC(C(=O)O)N

InChI

InChI=1S/C18H21NO4/c1-11(2)16-10-15(23-14-7-4-13(20)5-8-14)6-3-12(16)9-17(19)18(21)22/h3-8,10-11,17,20H,9,19H2,1-2H3,(H,21,22)