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

Systemtic Name: 2-[4-[(5-dodecoxy-6-methoxy-4-methyl-quinolin-8-yl)-methyl-amino]butyl]isoindole-1,3-dione Openeye Name: 2-[4-[(5-dodecoxy-6-methoxy-4-methyl-8-quinolyl)-methyl-amino]butyl]isoindoline-1,3-dione CAS Name: 2-[4-[(5-dodecoxy-6-methoxy-4-methyl-8-quinolinyl)-methylamino]butyl]isoindole-1,3-dione IUPAC Name: 2-[4-[(5-dodecoxy-6-methoxy-4-methylquinolin-8-yl)-methylamino]butyl]isoindole-1,3-dione Traditional Name: 2-[4-[(5-lauryloxy-6-methoxy-4-methyl-8-quinolyl)-methyl-amino]butyl]isoindoline-1,3-quinone Formula: C36H49N3O4 MolecularWeight: 587.79196

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC1=C(C=C(C2=NC=CC(=C12)C)N(C)CCCCN3C(=O)C4=CC=CC=C4C3=O)OC

Isomeric SMILES

CCCCCCCCCCCCOC1=C(C=C(C2=NC=CC(=C12)C)N(C)CCCCN3C(=O)C4=CC=CC=C4C3=O)OC

InChI

InChI=1S/C36H49N3O4/c1-5-6-7-8-9-10-11-12-13-18-25-43-34-31(42-4)26-30(33-32(34)27(2)21-22-37-33)38(3)23-16-17-24-39-35(40)28-19-14-15-20-29(28)36(39)41/h14-15,19-22,26H,5-13,16-18,23-25H2,1-4H3