1,3,5,8,10,12-hexatert-butylquinolino[2,3-b]acridine-7,14-dione

Systemtic Name: 1,3,5,8,10,12-hexatert-butylquinolino[2,3-b]acridine-7,14-dione Openeye Name: 1,3,5,8,10,12-hexatert-butylquinolino[2,3-b]acridine-7,14-dione CAS Name: 1,3,5,8,10,12-hexatert-butylquinolino[2,3-b]acridine-7,14-dione IUPAC Name: 1,3,5,8,10,12-hexatert-butylquinolino[2,3-b]acridine-7,14-dione Traditional Name: 1,3,5,8,10,12-hexatert-butylquinolin[2,3-b]acridine-7,14-quinone Formula: C44H60N2O2 MolecularWeight: 648.9594

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C2C(=C1)N(C3=CC4=C(C=C3C2=O)N(C5=CC(=CC(=C5C4=O)C(C)(C)C)C(C)(C)C)C(C)(C)C)C(C)(C)C)C(C)(C)C

Isomeric SMILES

CC(C)(C)C1=CC(=C2C(=C1)N(C3=CC4=C(C=C3C2=O)N(C5=CC(=CC(=C5C4=O)C(C)(C)C)C(C)(C)C)C(C)(C)C)C(C)(C)C)C(C)(C)C

InChI

InChI=1S/C44H60N2O2/c1-39(2,3)25-19-29(41(7,8)9)35-33(21-25)45(43(13,14)15)31-23-28-32(24-27(31)37(35)47)46(44(16,17)18)34-22-26(40(4,5)6)20-30(42(10,11)12)36(34)38(28)48/h19-24H,1-18H3