(3S,6S)-3,6-diphenylcyclohexa-1,4-diene-1,2-dicarboxylic acid

Systemtic Name: (3S,6S)-3,6-diphenylcyclohexa-1,4-diene-1,2-dicarboxylic acid Openeye Name: (3S,6S)-3,6-diphenylcyclohexa-1,4-diene-1,2-dicarboxylic acid CAS Name: (3S,6S)-3,6-diphenylcyclohexa-1,4-diene-1,2-dicarboxylic acid IUPAC Name: (3S,6S)-3,6-diphenylcyclohexa-1,4-diene-1,2-dicarboxylic acid Traditional Name: (3S,6S)-3,6-diphenylcyclohexa-1,4-diene-1,2-dicarboxylic acid Formula: C20H16O4 MolecularWeight: 320.33864

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2C=CC(C(=C2C(=O)O)C(=O)O)C3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)[C@@H]2C=C[C@H](C(=C2C(=O)O)C(=O)O)C3=CC=CC=C3

InChI

InChI=1S/C20H16O4/c21-19(22)17-15(13-7-3-1-4-8-13)11-12-16(18(17)20(23)24)14-9-5-2-6-10-14/h1-12,15-16H,(H,21,22)(H,23,24)/t15-,16-/m0/s1