2-azanyl-3-[3,4-bis(oxidanyl)phenyl]propanamide; ethanoic acid

Systemtic Name: 2-azanyl-3-[3,4-bis(oxidanyl)phenyl]propanamide; ethanoic acid Openeye Name: acetic acid; 2-amino-3-(3,4-dihydroxyphenyl)propanamide CAS Name: acetic acid; 2-amino-3-(3,4-dihydroxyphenyl)propanamide IUPAC Name: acetic acid; 2-amino-3-(3,4-dihydroxyphenyl)propanamide Traditional Name: acetic acid; 2-amino-3-(3,4-dihydroxyphenyl)propionamide Formula: C11H16N2O5 MolecularWeight: 256.25514

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)O.C1=CC(=C(C=C1CC(C(=O)N)N)O)O

Isomeric SMILES

CC(=O)O.C1=CC(=C(C=C1CC(C(=O)N)N)O)O

InChI

InChI=1S/C9H12N2O3.C2H4O2/c10-6(9(11)14)3-5-1-2-7(12)8(13)4-5;1-2(3)4/h1-2,4,6,12-13H,3,10H2,(H2,11,14);1H3,(H,3,4)