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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C2=C1C=C(C=C2)OCC3=CC=CC=C3)CC4=CC=C(C=C4)OCCN5CCCCCC5)C6=CC(=CC=C6)OCC7=CC=CC=C7

Isomeric SMILES

CC1=C(N(C2=C1C=C(C=C2)OCC3=CC=CC=C3)CC4=CC=C(C=C4)OCCN5CCCCCC5)C6=CC(=CC=C6)OCC7=CC=CC=C7

InChI

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