3-[3,4-bis(oxidanyl)phenyl]-2-(ethylamino)-2-methyl-propanoate

Systemtic Name: 3-[3,4-bis(oxidanyl)phenyl]-2-(ethylamino)-2-methyl-propanoate Openeye Name: 3-(3,4-dihydroxyphenyl)-2-(ethylamino)-2-methyl-propanoate CAS Name: 3-(3,4-dihydroxyphenyl)-2-(ethylamino)-2-methylpropanoate IUPAC Name: 3-(3,4-dihydroxyphenyl)-2-(ethylamino)-2-methylpropanoate Traditional Name: 3-(3,4-dihydroxyphenyl)-2-(ethylamino)-2-methyl-propionate Formula: C12H16NO4- MolecularWeight: 238.25974

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(C)(CC1=CC(=C(C=C1)O)O)C(=O)[O-]

Isomeric SMILES

CCNC(C)(CC1=CC(=C(C=C1)O)O)C(=O)[O-]

InChI

InChI=1S/C12H17NO4/c1-3-13-12(2,11(16)17)7-8-4-5-9(14)10(15)6-8/h4-6,13-15H,3,7H2,1-2H3,(H,16,17)/p-1