2,5-bis[(4-bromophenyl)amino]cyclohexa-1,4-diene-1,4-dicarboxylic acid

Systemtic Name: 2,5-bis[(4-bromophenyl)amino]cyclohexa-1,4-diene-1,4-dicarboxylic acid Openeye Name: 2,5-bis(4-bromoanilino)cyclohexa-1,4-diene-1,4-dicarboxylic acid CAS Name: 2,5-bis(4-bromoanilino)cyclohexa-1,4-diene-1,4-dicarboxylic acid IUPAC Name: 2,5-bis(4-bromoanilino)cyclohexa-1,4-diene-1,4-dicarboxylic acid Traditional Name: 2,5-bis(4-bromoanilino)cyclohexa-1,4-diene-1,4-dicarboxylic acid Formula: C20H16Br2N2O4 MolecularWeight: 508.16004

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(=C(CC(=C1NC2=CC=C(C=C2)Br)C(=O)O)NC3=CC=C(C=C3)Br)C(=O)O

Isomeric SMILES

C1C(=C(CC(=C1NC2=CC=C(C=C2)Br)C(=O)O)NC3=CC=C(C=C3)Br)C(=O)O

InChI

InChI=1S/C20H16Br2N2O4/c21-11-1-5-13(6-2-11)23-17-9-16(20(27)28)18(10-15(17)19(25)26)24-14-7-3-12(22)4-8-14/h1-8,23-24H,9-10H2,(H,25,26)(H,27,28)