2-[4-[(5-decoxy-6-methoxy-quinolin-8-yl)-methyl-amino]butyl]isoindole-1,3-dione

Systemtic Name: 2-[4-[(5-decoxy-6-methoxy-quinolin-8-yl)-methyl-amino]butyl]isoindole-1,3-dione Openeye Name: 2-[4-[(5-decoxy-6-methoxy-8-quinolyl)-methyl-amino]butyl]isoindoline-1,3-dione CAS Name: 2-[4-[(5-decoxy-6-methoxy-8-quinolinyl)-methylamino]butyl]isoindole-1,3-dione IUPAC Name: 2-[4-[(5-decoxy-6-methoxyquinolin-8-yl)-methylamino]butyl]isoindole-1,3-dione Traditional Name: 2-[4-[(5-decoxy-6-methoxy-8-quinolyl)-methyl-amino]butyl]isoindoline-1,3-quinone Formula: C33H43N3O4 MolecularWeight: 545.71222

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC1=C(C=C(C2=C1C=CC=N2)N(C)CCCCN3C(=O)C4=CC=CC=C4C3=O)OC

Isomeric SMILES

CCCCCCCCCCOC1=C(C=C(C2=C1C=CC=N2)N(C)CCCCN3C(=O)C4=CC=CC=C4C3=O)OC

InChI

InChI=1S/C33H43N3O4/c1-4-5-6-7-8-9-10-15-23-40-31-27-19-16-20-34-30(27)28(24-29(31)39-3)35(2)21-13-14-22-36-32(37)25-17-11-12-18-26(25)33(36)38/h11-12,16-20,24H,4-10,13-15,21-23H2,1-3H3