3-azanyl-4-(3-ethanoyl-4-oxidanyl-phenyl)butan-2-one

Systemtic Name: 3-azanyl-4-(3-ethanoyl-4-oxidanyl-phenyl)butan-2-one Openeye Name: 4-(3-acetyl-4-hydroxy-phenyl)-3-amino-butan-2-one CAS Name: 4-(3-acetyl-4-hydroxyphenyl)-3-amino-2-butanone IUPAC Name: 4-(3-acetyl-4-hydroxyphenyl)-3-aminobutan-2-one Traditional Name: 4-(3-acetyl-4-hydroxy-phenyl)-3-amino-butan-2-one Formula: C12H15NO3 MolecularWeight: 221.2524

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H15NO3/c1-7(14)10-5-9(3-4-12(10)16)6-11(13)8(2)15/h3-5,11,16H,6,13H2,1-2H3