3-[4,6-bis(chloranyl)-7-(3-methylbut-2-enyl)-1H-indol-3-yl]-2,5-bis(oxidanyl)cyclohexa-2,5-diene-1,4-dione

Systemtic Name: 3-[4,6-bis(chloranyl)-7-(3-methylbut-2-enyl)-1H-indol-3-yl]-2,5-bis(oxidanyl)cyclohexa-2,5-diene-1,4-dione Openeye Name: 3-[4,6-dichloro-7-(3-methylbut-2-enyl)-1H-indol-3-yl]-2,5-dihydroxy-1,4-benzoquinone CAS Name: 3-[4,6-dichloro-7-(3-methylbut-2-enyl)-1H-indol-3-yl]-2,5-dihydroxycyclohexa-2,5-diene-1,4-dione IUPAC Name: 3-[4,6-dichloro-7-(3-methylbut-2-enyl)-1H-indol-3-yl]-2,5-dihydroxycyclohexa-2,5-diene-1,4-dione Traditional Name: 3-[4,6-dichloro-7-(3-methylbut-2-enyl)-1H-indol-3-yl]-2,5-dihydroxy-p-benzoquinone Formula: C19H15Cl2NO4 MolecularWeight: 392.2327

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=CCC1=C(C=C(C2=C1NC=C2C3=C(C(=O)C=C(C3=O)O)O)Cl)Cl)C

Isomeric SMILES

CC(=CCC1=C(C=C(C2=C1NC=C2C3=C(C(=O)C=C(C3=O)O)O)Cl)Cl)C

InChI

InChI=1S/C19H15Cl2NO4/c1-8(2)3-4-9-11(20)5-12(21)15-10(7-22-17(9)15)16-18(25)13(23)6-14(24)19(16)26/h3,5-7,22-23,26H,4H2,1-2H3