2-azanyl-2-[[3,4-bis(oxidanyl)phenyl]methyl]penta-3,4-dienoic acid

Systemtic Name: 2-azanyl-2-[[3,4-bis(oxidanyl)phenyl]methyl]penta-3,4-dienoic acid Openeye Name: 2-amino-2-[(3,4-dihydroxyphenyl)methyl]penta-3,4-dienoic acid CAS Name: 2-amino-2-[(3,4-dihydroxyphenyl)methyl]penta-3,4-dienoic acid IUPAC Name: 2-amino-2-[(3,4-dihydroxyphenyl)methyl]penta-3,4-dienoic acid Traditional Name: 2-amino-2-protocatechuyl-penta-3,4-dienoic acid Formula: C12H13NO4 MolecularWeight: 235.23592

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Descriptors Computed from Structure

Canonical SMILES:

C=C=CC(CC1=CC(=C(C=C1)O)O)(C(=O)O)N

Isomeric SMILES

C=C=CC(CC1=CC(=C(C=C1)O)O)(C(=O)O)N

InChI

InChI=1S/C12H13NO4/c1-2-5-12(13,11(16)17)7-8-3-4-9(14)10(15)6-8/h3-6,14-15H,1,7,13H2,(H,16,17)