2-azanyl-4-[4-(2,4,4-trimethylpentan-2-yl)phenoxy]pentanedioic acid

Systemtic Name: 2-azanyl-4-[4-(2,4,4-trimethylpentan-2-yl)phenoxy]pentanedioic acid Openeye Name: 2-amino-4-[4-(1,1,3,3-tetramethylbutyl)phenoxy]pentanedioic acid CAS Name: 2-amino-4-[4-(2,4,4-trimethylpentan-2-yl)phenoxy]pentanedioic acid IUPAC Name: 2-amino-4-[4-(2,4,4-trimethylpentan-2-yl)phenoxy]pentanedioic acid Traditional Name: 2-amino-4-[4-(1,1,3,3-tetramethylbutyl)phenoxy]glutaric acid Formula: C19H29NO5 MolecularWeight: 351.43726

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(C)(C)C1=CC=C(C=C1)OC(CC(C(=O)O)N)C(=O)O

Isomeric SMILES

CC(C)(C)CC(C)(C)C1=CC=C(C=C1)OC(CC(C(=O)O)N)C(=O)O

InChI

InChI=1S/C19H29NO5/c1-18(2,3)11-19(4,5)12-6-8-13(9-7-12)25-15(17(23)24)10-14(20)16(21)22/h6-9,14-15H,10-11,20H2,1-5H3,(H,21,22)(H,23,24)