6-(2-bromoethylamino)-2-butyl-7-(pyridin-2-ylmethylamino)benzo[de]isoquinoline-1,3-dione

Systemtic Name: 6-(2-bromoethylamino)-2-butyl-7-(pyridin-2-ylmethylamino)benzo[de]isoquinoline-1,3-dione Openeye Name: 6-(2-bromoethylamino)-2-butyl-7-(2-pyridylmethylamino)benzo[de]isoquinoline-1,3-dione CAS Name: 6-(2-bromoethylamino)-2-butyl-7-(2-pyridinylmethylamino)benzo[de]isoquinoline-1,3-dione IUPAC Name: 6-(2-bromoethylamino)-2-butyl-7-(pyridin-2-ylmethylamino)benzo[de]isoquinoline-1,3-dione Traditional Name: 6-(2-bromoethylamino)-2-butyl-7-(2-pyridylmethylamino)benzo[de]isoquinoline-1,3-quinone Formula: C24H25BrN4O2 MolecularWeight: 481.3849

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=C3C(=CC=C(C3=C(C=C2)NCC4=CC=CC=N4)NCCBr)C1=O

Isomeric SMILES

CCCCN1C(=O)C2=C3C(=CC=C(C3=C(C=C2)NCC4=CC=CC=N4)NCCBr)C1=O

InChI

InChI=1S/C24H25BrN4O2/c1-2-3-14-29-23(30)17-7-9-19(27-13-11-25)22-20(10-8-18(21(17)22)24(29)31)28-15-16-6-4-5-12-26-16/h4-10,12,27-28H,2-3,11,13-15H2,1H3