(E)-3-[2-[(E)-3-oxidanidyl-3-oxidanylidene-prop-1-enyl]-3-oxidanyl-phenyl]prop-2-enoate; phenol

Systemtic Name: (E)-3-[2-[(E)-3-oxidanidyl-3-oxidanylidene-prop-1-enyl]-3-oxidanyl-phenyl]prop-2-enoate; phenol Openeye Name: (E)-3-[3-hydroxy-2-[(E)-3-oxido-3-oxo-prop-1-enyl]phenyl]prop-2-enoate; phenol CAS Name: (E)-3-[3-hydroxy-2-[(E)-3-oxido-3-oxoprop-1-enyl]phenyl]-2-propenoate; phenol IUPAC Name: (E)-3-[3-hydroxy-2-[(E)-3-oxido-3-oxoprop-1-enyl]phenyl]prop-2-enoate; phenol Traditional Name: (E)-3-[3-hydroxy-2-[(E)-3-keto-3-oxido-prop-1-enyl]phenyl]acrylate; phenol Formula: C18H14O6-2 MolecularWeight: 326.30016

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)O.C1=CC(=C(C(=C1)O)C=CC(=O)[O-])C=CC(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)O.C1=CC(=C(C(=C1)O)/C=C/C(=O)[O-])/C=C/C(=O)[O-]

InChI

InChI=1S/C12H10O5.C6H6O/c13-10-3-1-2-8(4-6-11(14)15)9(10)5-7-12(16)17;7-6-4-2-1-3-5-6/h1-7,13H,(H,14,15)(H,16,17);1-5,7H/p-2/b6-4+,7-5+;