2-(8-methylquinolin-5-yl)-6-pyrrolidin-1-yl-benzo[de]isoquinoline-1,3-dione

Systemtic Name: 2-(8-methylquinolin-5-yl)-6-pyrrolidin-1-yl-benzo[de]isoquinoline-1,3-dione Openeye Name: 2-(8-methyl-5-quinolyl)-6-pyrrolidin-1-yl-benzo[de]isoquinoline-1,3-dione CAS Name: 2-(8-methyl-5-quinolinyl)-6-(1-pyrrolidinyl)benzo[de]isoquinoline-1,3-dione IUPAC Name: 2-(8-methylquinolin-5-yl)-6-pyrrolidin-1-ylbenzo[de]isoquinoline-1,3-dione Traditional Name: 2-(8-methyl-5-quinolyl)-6-pyrrolidino-benzo[de]isoquinoline-1,3-quinone Formula: C26H21N3O2 MolecularWeight: 407.46384

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C=C1)N3C(=O)C4=C5C(=C(C=C4)N6CCCC6)C=CC=C5C3=O)C=CC=N2

Isomeric SMILES

CC1=C2C(=C(C=C1)N3C(=O)C4=C5C(=C(C=C4)N6CCCC6)C=CC=C5C3=O)C=CC=N2

InChI

InChI=1S/C26H21N3O2/c1-16-9-11-22(18-8-5-13-27-24(16)18)29-25(30)19-7-4-6-17-21(28-14-2-3-15-28)12-10-20(23(17)19)26(29)31/h4-13H,2-3,14-15H2,1H3