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

Systemtic Name: 1-[[4-[2-(azepan-1-yl)ethoxy]phenyl]methyl]-2-(4-ethoxyphenyl)-3-methyl-5-phenylmethoxy-indole Openeye Name: 1-[[4-[2-(azepan-1-yl)ethoxy]phenyl]methyl]-5-benzyloxy-2-(4-ethoxyphenyl)-3-methyl-indole CAS Name: 1-[[4-[2-(1-azepanyl)ethoxy]phenyl]methyl]-2-(4-ethoxyphenyl)-3-methyl-5-phenylmethoxyindole IUPAC Name: 1-[[4-[2-(azepan-1-yl)ethoxy]phenyl]methyl]-2-(4-ethoxyphenyl)-3-methyl-5-phenylmethoxyindole Traditional Name: 1-[4-[2-(azepan-1-yl)ethoxy]benzyl]-5-benzoxy-3-methyl-2-p-phenetyl-indole Formula: C39H44N2O3 MolecularWeight: 588.77826

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=C(C3=C(N2CC4=CC=C(C=C4)OCCN5CCCCCC5)C=CC(=C3)OCC6=CC=CC=C6)C

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=C(C3=C(N2CC4=CC=C(C=C4)OCCN5CCCCCC5)C=CC(=C3)OCC6=CC=CC=C6)C

InChI

InChI=1S/C39H44N2O3/c1-3-42-34-19-15-33(16-20-34)39-30(2)37-27-36(44-29-32-11-7-6-8-12-32)21-22-38(37)41(39)28-31-13-17-35(18-14-31)43-26-25-40-23-9-4-5-10-24-40/h6-8,11-22,27H,3-5,9-10,23-26,28-29H2,1-2H3