methyl 4-[3-(tert-butylamino)-2-oxidanyl-propoxy]-3-(4-methoxy-4-oxidanylidene-butanoyl)benzoate

Systemtic Name: methyl 4-[3-(tert-butylamino)-2-oxidanyl-propoxy]-3-(4-methoxy-4-oxidanylidene-butanoyl)benzoate Openeye Name: methyl 4-[3-(tert-butylamino)-2-hydroxy-propoxy]-3-(4-methoxy-4-oxo-butanoyl)benzoate CAS Name: 4-[3-(tert-butylamino)-2-hydroxypropoxy]-3-(4-methoxy-1,4-dioxobutyl)benzoic acid methyl ester IUPAC Name: methyl 4-[3-(tert-butylamino)-2-hydroxypropoxy]-3-(4-methoxy-4-oxobutanoyl)benzoate Traditional Name: 4-[3-(tert-butylamino)-2-hydroxy-propoxy]-3-(4-keto-4-methoxy-butanoyl)benzoic acid methyl ester Formula: C20H29NO7 MolecularWeight: 395.44676

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H29NO7/c1-20(2,3)21-11-14(22)12-28-17-8-6-13(19(25)27-5)10-15(17)16(23)7-9-18(24)26-4/h6,8,10,14,21-22H,7,9,11-12H2,1-5H3