methyl 2-[1-[2,5-bis(oxidanyl)phenyl]ethylamino]-3-methyl-pentanoate

Systemtic Name: methyl 2-[1-[2,5-bis(oxidanyl)phenyl]ethylamino]-3-methyl-pentanoate Openeye Name: methyl 2-[1-(2,5-dihydroxyphenyl)ethylamino]-3-methyl-pentanoate CAS Name: 2-[1-(2,5-dihydroxyphenyl)ethylamino]-3-methylpentanoic acid methyl ester IUPAC Name: methyl 2-[1-(2,5-dihydroxyphenyl)ethylamino]-3-methylpentanoate Traditional Name: 2-[1-(2,5-dihydroxyphenyl)ethylamino]-3-methyl-valeric acid methyl ester Formula: C15H23NO4 MolecularWeight: 281.34742

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)OC)NC(C)C1=C(C=CC(=C1)O)O

Isomeric SMILES

CCC(C)C(C(=O)OC)NC(C)C1=C(C=CC(=C1)O)O

InChI

InChI=1S/C15H23NO4/c1-5-9(2)14(15(19)20-4)16-10(3)12-8-11(17)6-7-13(12)18/h6-10,14,16-18H,5H2,1-4H3