1-[[4-(azepan-2-yl)phenyl]-ethoxy-methyl]-3-methyl-5-phenylmethoxy-2-(3-phenylmethoxyphenyl)indole

Systemtic Name: 1-[[4-(azepan-2-yl)phenyl]-ethoxy-methyl]-3-methyl-5-phenylmethoxy-2-(3-phenylmethoxyphenyl)indole Openeye Name: 1-[[4-(azepan-2-yl)phenyl]-ethoxy-methyl]-5-benzyloxy-2-(3-benzyloxyphenyl)-3-methyl-indole CAS Name: 1-[[4-(2-azepanyl)phenyl]-ethoxymethyl]-3-methyl-5-phenylmethoxy-2-(3-phenylmethoxyphenyl)indole IUPAC Name: 1-[[4-(azepan-2-yl)phenyl]-ethoxymethyl]-3-methyl-5-phenylmethoxy-2-(3-phenylmethoxyphenyl)indole Traditional Name: 1-[[4-(azepan-2-yl)phenyl]-ethoxy-methyl]-5-benzoxy-2-(3-benzoxyphenyl)-3-methyl-indole Formula: C44H46N2O3 MolecularWeight: 650.84764

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(C1=CC=C(C=C1)C2CCCCCN2)N3C4=C(C=C(C=C4)OCC5=CC=CC=C5)C(=C3C6=CC(=CC=C6)OCC7=CC=CC=C7)C

Isomeric SMILES

CCOC(C1=CC=C(C=C1)C2CCCCCN2)N3C4=C(C=C(C=C4)OCC5=CC=CC=C5)C(=C3C6=CC(=CC=C6)OCC7=CC=CC=C7)C

InChI

InChI=1S/C44H46N2O3/c1-3-47-44(36-23-21-35(22-24-36)41-20-11-6-12-27-45-41)46-42-26-25-39(49-31-34-16-9-5-10-17-34)29-40(42)32(2)43(46)37-18-13-19-38(28-37)48-30-33-14-7-4-8-15-33/h4-5,7-10,13-19,21-26,28-29,41,44-45H,3,6,11-12,20,27,30-31H2,1-2H3