5,6-bis(5,6,7,8-tetrahydronaphthalen-1-ylamino)isoindole-1,3-dione

Systemtic Name: 5,6-bis(5,6,7,8-tetrahydronaphthalen-1-ylamino)isoindole-1,3-dione Openeye Name: 5,6-bis(tetralin-5-ylamino)isoindoline-1,3-dione CAS Name: 5,6-bis(5,6,7,8-tetrahydronaphthalen-1-ylamino)isoindole-1,3-dione IUPAC Name: 5,6-bis(5,6,7,8-tetrahydronaphthalen-1-ylamino)isoindole-1,3-dione Traditional Name: 5,6-bis(tetralin-5-ylamino)isoindoline-1,3-quinone Formula: C28H27N3O2 MolecularWeight: 437.53288

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C=CC=C2NC3=C(C=C4C(=C3)C(=O)NC4=O)NC5=CC=CC6=C5CCCC6

Isomeric SMILES

C1CCC2=C(C1)C=CC=C2NC3=C(C=C4C(=C3)C(=O)NC4=O)NC5=CC=CC6=C5CCCC6

InChI

InChI=1S/C28H27N3O2/c32-27-21-15-25(29-23-13-5-9-17-7-1-3-11-19(17)23)26(16-22(21)28(33)31-27)30-24-14-6-10-18-8-2-4-12-20(18)24/h5-6,9-10,13-16,29-30H,1-4,7-8,11-12H2,(H,31,32,33)