2-azanyl-2-tert-butyl-4-(4-chloranylphenoxy)-3-oxidanylidene-octanoic acid

Systemtic Name: 2-azanyl-2-tert-butyl-4-(4-chloranylphenoxy)-3-oxidanylidene-octanoic acid Openeye Name: 2-amino-2-tert-butyl-4-(4-chlorophenoxy)-3-oxo-octanoic acid CAS Name: 2-amino-2-tert-butyl-4-(4-chlorophenoxy)-3-oxooctanoic acid IUPAC Name: 2-amino-2-tert-butyl-4-(4-chlorophenoxy)-3-oxooctanoic acid Traditional Name: 2-amino-2-tert-butyl-4-(4-chlorophenoxy)-3-keto-caprylic acid Formula: C18H26ClNO4 MolecularWeight: 355.85634

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)C(C(=O)O)(C(C)(C)C)N)OC1=CC=C(C=C1)Cl

Isomeric SMILES

CCCCC(C(=O)C(C(=O)O)(C(C)(C)C)N)OC1=CC=C(C=C1)Cl

InChI

InChI=1S/C18H26ClNO4/c1-5-6-7-14(24-13-10-8-12(19)9-11-13)15(21)18(20,16(22)23)17(2,3)4/h8-11,14H,5-7,20H2,1-4H3,(H,22,23)