4-[(E)-(1-oxidanylidene-3,4-dihydronaphthalen-2-ylidene)methyl]benzene-1,3-disulfonic acid

Systemtic Name: 4-[(E)-(1-oxidanylidene-3,4-dihydronaphthalen-2-ylidene)methyl]benzene-1,3-disulfonic acid Openeye Name: 4-[(E)-(1-oxotetralin-2-ylidene)methyl]benzene-1,3-disulfonic acid CAS Name: 4-[(E)-(1-oxo-3,4-dihydronaphthalen-2-ylidene)methyl]benzene-1,3-disulfonic acid IUPAC Name: 4-[(E)-(1-oxo-3,4-dihydronaphthalen-2-ylidene)methyl]benzene-1,3-disulfonic acid Traditional Name: 4-[(E)-(1-ketotetralin-2-ylidene)methyl]benzene-1,3-disulfonic acid Formula: C17H14O7S2 MolecularWeight: 394.41886

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(=CC2=C(C=C(C=C2)S(=O)(=O)O)S(=O)(=O)O)C(=O)C3=CC=CC=C31

Isomeric SMILES

C1C/C(=C\C2=C(C=C(C=C2)S(=O)(=O)O)S(=O)(=O)O)/C(=O)C3=CC=CC=C31

InChI

InChI=1S/C17H14O7S2/c18-17-13(6-5-11-3-1-2-4-15(11)17)9-12-7-8-14(25(19,20)21)10-16(12)26(22,23)24/h1-4,7-10H,5-6H2,(H,19,20,21)(H,22,23,24)/b13-9+