3-[1,2-bis(azanyl)ethyl]-4-ethanoyl-2-oxidanyl-benzoic acid

Systemtic Name: 3-[1,2-bis(azanyl)ethyl]-4-ethanoyl-2-oxidanyl-benzoic acid Openeye Name: 4-acetyl-3-(1,2-diaminoethyl)-2-hydroxy-benzoic acid CAS Name: 4-acetyl-3-(1,2-diaminoethyl)-2-hydroxybenzoic acid IUPAC Name: 4-acetyl-3-(1,2-diaminoethyl)-2-hydroxybenzoic acid Traditional Name: 4-acetyl-3-(1,2-diaminoethyl)-2-hydroxy-benzoic acid Formula: C11H14N2O4 MolecularWeight: 238.23986

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H14N2O4/c1-5(14)6-2-3-7(11(16)17)10(15)9(6)8(13)4-12/h2-3,8,15H,4,12-13H2,1H3,(H,16,17)