(E)-3-[3-azanyl-4-[(E)-3-oxidanyl-3-oxidanylidene-prop-1-enyl]phenyl]prop-2-enoic acid

Systemtic Name: (E)-3-[3-azanyl-4-[(E)-3-oxidanyl-3-oxidanylidene-prop-1-enyl]phenyl]prop-2-enoic acid Openeye Name: (E)-3-[3-amino-4-[(E)-3-hydroxy-3-oxo-prop-1-enyl]phenyl]prop-2-enoic acid CAS Name: (E)-3-[3-amino-4-[(E)-3-hydroxy-3-oxoprop-1-enyl]phenyl]-2-propenoic acid IUPAC Name: (E)-3-[3-amino-4-[(E)-3-hydroxy-3-oxoprop-1-enyl]phenyl]prop-2-enoic acid Traditional Name: (E)-3-[3-amino-4-[(E)-3-hydroxy-3-keto-prop-1-enyl]phenyl]acrylic acid Formula: C12H11NO4 MolecularWeight: 233.22004

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C=CC(=O)O)N)C=CC(=O)O

Isomeric SMILES

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

InChI

InChI=1S/C12H11NO4/c13-10-7-8(2-5-11(14)15)1-3-9(10)4-6-12(16)17/h1-7H,13H2,(H,14,15)(H,16,17)/b5-2+,6-4+