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

Systemtic Name: 1-[[4-[1-(azepan-2-yl)ethoxy]phenyl]methyl]-3-methyl-5-phenylmethoxy-2-(3-phenylmethoxyphenyl)indole Openeye Name: 1-[[4-[1-(azepan-2-yl)ethoxy]phenyl]methyl]-5-benzyloxy-2-(3-benzyloxyphenyl)-3-methyl-indole CAS Name: 1-[[4-[1-(2-azepanyl)ethoxy]phenyl]methyl]-3-methyl-5-phenylmethoxy-2-(3-phenylmethoxyphenyl)indole IUPAC Name: 1-[[4-[1-(azepan-2-yl)ethoxy]phenyl]methyl]-3-methyl-5-phenylmethoxy-2-(3-phenylmethoxyphenyl)indole Traditional Name: 1-[4-[1-(azepan-2-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)OC(C)C5CCCCCN5)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)OC(C)C5CCCCCN5)C6=CC(=CC=C6)OCC7=CC=CC=C7

InChI

InChI=1S/C44H46N2O3/c1-32-41-28-40(48-31-36-15-8-4-9-16-36)24-25-43(41)46(44(32)37-17-12-18-39(27-37)47-30-35-13-6-3-7-14-35)29-34-20-22-38(23-21-34)49-33(2)42-19-10-5-11-26-45-42/h3-4,6-9,12-18,20-25,27-28,33,42,45H,5,10-11,19,26,29-31H2,1-2H3