2-(11-azanyl-2,2,12-trimethyl-tridecyl)-3a,4,5,9b-tetrahydrobenzo[e]isoindole-1,3-dione

Systemtic Name: 2-(11-azanyl-2,2,12-trimethyl-tridecyl)-3a,4,5,9b-tetrahydrobenzo[e]isoindole-1,3-dione Openeye Name: 2-(11-amino-2,2,12-trimethyl-tridecyl)-3a,4,5,9b-tetrahydrobenzo[e]isoindole-1,3-dione CAS Name: 2-(11-amino-2,2,12-trimethyltridecyl)-3a,4,5,9b-tetrahydrobenzo[e]isoindole-1,3-dione IUPAC Name: 2-(11-amino-2,2,12-trimethyltridecyl)-3a,4,5,9b-tetrahydrobenzo[e]isoindole-1,3-dione Traditional Name: 2-(11-amino-2,2,12-trimethyl-tridecyl)-3a,4,5,9b-tetrahydrobenz[e]isoindole-1,3-quinone Formula: C28H44N2O2 MolecularWeight: 440.66116

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CCCCCCCCC(C)(C)CN1C(=O)C2CCC3=CC=CC=C3C2C1=O)N

Isomeric SMILES

CC(C)C(CCCCCCCCC(C)(C)CN1C(=O)C2CCC3=CC=CC=C3C2C1=O)N

InChI

InChI=1S/C28H44N2O2/c1-20(2)24(29)15-9-7-5-6-8-12-18-28(3,4)19-30-26(31)23-17-16-21-13-10-11-14-22(21)25(23)27(30)32/h10-11,13-14,20,23-25H,5-9,12,15-19,29H2,1-4H3