1,1-dibutyl-3-(5-phenyl-1H-imidazol-2-yl)-6-phenylmethoxy-2,3,4,9-tetrahydropyrido[3,4-b]indole

Systemtic Name: 1,1-dibutyl-3-(5-phenyl-1H-imidazol-2-yl)-6-phenylmethoxy-2,3,4,9-tetrahydropyrido[3,4-b]indole Openeye Name: 6-benzyloxy-1,1-dibutyl-3-(5-phenyl-1H-imidazol-2-yl)-2,3,4,9-tetrahydropyrido[3,4-b]indole CAS Name: 1,1-dibutyl-3-(5-phenyl-1H-imidazol-2-yl)-6-phenylmethoxy-2,3,4,9-tetrahydropyrido[3,4-b]indole IUPAC Name: 1,1-dibutyl-3-(5-phenyl-1H-imidazol-2-yl)-6-phenylmethoxy-2,3,4,9-tetrahydropyrido[3,4-b]indole Traditional Name: 6-benzoxy-1,1-dibutyl-3-(5-phenyl-1H-imidazol-2-yl)-2,3,4,9-tetrahydro-$b-carboline Formula: C35H40N4O MolecularWeight: 532.7183

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1(C2=C(CC(N1)C3=NC=C(N3)C4=CC=CC=C4)C5=C(N2)C=CC(=C5)OCC6=CC=CC=C6)CCCC

Isomeric SMILES

CCCCC1(C2=C(CC(N1)C3=NC=C(N3)C4=CC=CC=C4)C5=C(N2)C=CC(=C5)OCC6=CC=CC=C6)CCCC

InChI

InChI=1S/C35H40N4O/c1-3-5-19-35(20-6-4-2)33-29(22-31(39-35)34-36-23-32(38-34)26-15-11-8-12-16-26)28-21-27(17-18-30(28)37-33)40-24-25-13-9-7-10-14-25/h7-18,21,23,31,37,39H,3-6,19-20,22,24H2,1-2H3,(H,36,38)