3-[(E)-hex-1-enyl]-4-oxidanyl-naphthalene-1,2-dione

Systemtic Name: 3-[(E)-hex-1-enyl]-4-oxidanyl-naphthalene-1,2-dione Openeye Name: 3-[(E)-hex-1-enyl]-4-hydroxy-naphthalene-1,2-dione CAS Name: 3-[(E)-hex-1-enyl]-4-hydroxynaphthalene-1,2-dione IUPAC Name: 3-[(E)-hex-1-enyl]-4-hydroxynaphthalene-1,2-dione Traditional Name: 3-[(E)-hex-1-enyl]-4-hydroxy-1,2-naphthoquinone Formula: C16H16O3 MolecularWeight: 256.29644

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC=CC1=C(C2=CC=CC=C2C(=O)C1=O)O

Isomeric SMILES

CCCC/C=C/C1=C(C2=CC=CC=C2C(=O)C1=O)O

InChI

InChI=1S/C16H16O3/c1-2-3-4-5-10-13-14(17)11-8-6-7-9-12(11)15(18)16(13)19/h5-10,17H,2-4H2,1H3/b10-5+