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

Systemtic Name: methyl 4-[5-azanyl-2-[3-(tert-butylamino)-2-oxidanyl-propoxy]phenyl]-4-oxidanylidene-butanoate Openeye Name: methyl 4-[5-amino-2-[3-(tert-butylamino)-2-hydroxy-propoxy]phenyl]-4-oxo-butanoate CAS Name: 4-[5-amino-2-[3-(tert-butylamino)-2-hydroxypropoxy]phenyl]-4-oxobutanoic acid methyl ester IUPAC Name: methyl 4-[5-amino-2-[3-(tert-butylamino)-2-hydroxypropoxy]phenyl]-4-oxobutanoate Traditional Name: 4-[5-amino-2-[3-(tert-butylamino)-2-hydroxy-propoxy]phenyl]-4-keto-butyric acid methyl ester Formula: C18H28N2O5 MolecularWeight: 352.42532

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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)OC)O

Isomeric SMILES

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

InChI

InChI=1S/C18H28N2O5/c1-18(2,3)20-10-13(21)11-25-16-7-5-12(19)9-14(16)15(22)6-8-17(23)24-4/h5,7,9,13,20-21H,6,8,10-11,19H2,1-4H3