N4-(2-tert-butyl-4-ethyl-6-methoxy-5-octoxy-quinolin-8-yl)pentane-1,4-diamine

Systemtic Name: N4-(2-tert-butyl-4-ethyl-6-methoxy-5-octoxy-quinolin-8-yl)pentane-1,4-diamine Openeye Name: N4-(2-tert-butyl-4-ethyl-6-methoxy-5-octoxy-8-quinolyl)pentane-1,4-diamine CAS Name: N4-(2-tert-butyl-4-ethyl-6-methoxy-5-octoxy-8-quinolinyl)pentane-1,4-diamine IUPAC Name: 4-N-(2-tert-butyl-4-ethyl-6-methoxy-5-octoxyquinolin-8-yl)pentane-1,4-diamine Traditional Name: (4-amino-1-methyl-butyl)-(2-tert-butyl-4-ethyl-6-methoxy-5-octoxy-8-quinolyl)amine Formula: C29H49N3O2 MolecularWeight: 471.71826

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=C(C=C(C2=C1C(=CC(=N2)C(C)(C)C)CC)NC(C)CCCN)OC

Isomeric SMILES

CCCCCCCCOC1=C(C=C(C2=C1C(=CC(=N2)C(C)(C)C)CC)NC(C)CCCN)OC

InChI

InChI=1S/C29H49N3O2/c1-8-10-11-12-13-14-18-34-28-24(33-7)20-23(31-21(3)16-15-17-30)27-26(28)22(9-2)19-25(32-27)29(4,5)6/h19-21,31H,8-18,30H2,1-7H3