methyl 4-[3-[1-(3-aminocarbonyl-4-oxidanyl-phenoxy)propan-2-ylamino]-2-oxidanyl-propoxy]-2-oxidanyl-benzoate

Systemtic Name: methyl 4-[3-[1-(3-aminocarbonyl-4-oxidanyl-phenoxy)propan-2-ylamino]-2-oxidanyl-propoxy]-2-oxidanyl-benzoate Openeye Name: methyl 4-[3-[[2-(3-carbamoyl-4-hydroxy-phenoxy)-1-methyl-ethyl]amino]-2-hydroxy-propoxy]-2-hydroxy-benzoate CAS Name: 4-[3-[1-(3-carbamoyl-4-hydroxyphenoxy)propan-2-ylamino]-2-hydroxypropoxy]-2-hydroxybenzoic acid methyl ester IUPAC Name: methyl 4-[3-[1-(3-carbamoyl-4-hydroxyphenoxy)propan-2-ylamino]-2-hydroxypropoxy]-2-hydroxybenzoate Traditional Name: 4-[3-[[2-(3-carbamoyl-4-hydroxy-phenoxy)-1-methyl-ethyl]amino]-2-hydroxy-propoxy]-2-hydroxy-benzoic acid methyl ester Formula: C21H26N2O8 MolecularWeight: 434.43974

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Descriptors Computed from Structure

Canonical SMILES:

CC(COC1=CC(=C(C=C1)O)C(=O)N)NCC(COC2=CC(=C(C=C2)C(=O)OC)O)O

Isomeric SMILES

CC(COC1=CC(=C(C=C1)O)C(=O)N)NCC(COC2=CC(=C(C=C2)C(=O)OC)O)O

InChI

InChI=1S/C21H26N2O8/c1-12(10-30-14-4-6-18(25)17(7-14)20(22)27)23-9-13(24)11-31-15-3-5-16(19(26)8-15)21(28)29-2/h3-8,12-13,23-26H,9-11H2,1-2H3,(H2,22,27)