3-[(E)-but-1-enyl]-4,8-bis(oxidanyl)naphthalene-1,2-dione

Systemtic Name: 3-[(E)-but-1-enyl]-4,8-bis(oxidanyl)naphthalene-1,2-dione Openeye Name: 3-[(E)-but-1-enyl]-4,8-dihydroxy-naphthalene-1,2-dione CAS Name: 3-[(E)-but-1-enyl]-4,8-dihydroxynaphthalene-1,2-dione IUPAC Name: 3-[(E)-but-1-enyl]-4,8-dihydroxynaphthalene-1,2-dione Traditional Name: 3-[(E)-but-1-enyl]-4,8-dihydroxy-1,2-naphthoquinone Formula: C14H12O4 MolecularWeight: 244.24268

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Descriptors Computed from Structure

Canonical SMILES:

CCC=CC1=C(C2=C(C(=CC=C2)O)C(=O)C1=O)O

Isomeric SMILES

CC/C=C/C1=C(C2=C(C(=CC=C2)O)C(=O)C1=O)O

InChI

InChI=1S/C14H12O4/c1-2-3-5-9-12(16)8-6-4-7-10(15)11(8)14(18)13(9)17/h3-7,15-16H,2H2,1H3/b5-3+