4-[5-azanyl-2-[3-(tert-butylamino)-2-oxidanyl-propoxy]phenyl]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[5-azanyl-2-[3-(tert-butylamino)-2-oxidanyl-propoxy]phenyl]-4-oxidanylidene-butanoic acid Openeye Name: 4-[5-amino-2-[3-(tert-butylamino)-2-hydroxy-propoxy]phenyl]-4-oxo-butanoic acid CAS Name: 4-[5-amino-2-[3-(tert-butylamino)-2-hydroxypropoxy]phenyl]-4-oxobutanoic acid IUPAC Name: 4-[5-amino-2-[3-(tert-butylamino)-2-hydroxypropoxy]phenyl]-4-oxobutanoic acid Traditional Name: 4-[5-amino-2-[3-(tert-butylamino)-2-hydroxy-propoxy]phenyl]-4-keto-butyric acid Formula: C17H26N2O5 MolecularWeight: 338.39874

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NCC(COC1=C(C=C(C=C1)N)C(=O)CCC(=O)O)O

Isomeric SMILES

CC(C)(C)NCC(COC1=C(C=C(C=C1)N)C(=O)CCC(=O)O)O

InChI

InChI=1S/C17H26N2O5/c1-17(2,3)19-9-12(20)10-24-15-6-4-11(18)8-13(15)14(21)5-7-16(22)23/h4,6,8,12,19-20H,5,7,9-10,18H2,1-3H3,(H,22,23)