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

Systemtic Name: 1-[[4-[1-(azepan-2-yl)ethoxy]phenyl]methyl]-3-methyl-2-phenyl-5-phenylmethoxy-indole Openeye Name: 1-[[4-[1-(azepan-2-yl)ethoxy]phenyl]methyl]-5-benzyloxy-3-methyl-2-phenyl-indole CAS Name: 1-[[4-[1-(2-azepanyl)ethoxy]phenyl]methyl]-3-methyl-2-phenyl-5-phenylmethoxyindole IUPAC Name: 1-[[4-[1-(azepan-2-yl)ethoxy]phenyl]methyl]-3-methyl-2-phenyl-5-phenylmethoxyindole Traditional Name: 1-[4-[1-(azepan-2-yl)ethoxy]benzyl]-5-benzoxy-3-methyl-2-phenyl-indole Formula: C37H40N2O2 MolecularWeight: 544.7257

Click to see the large picture

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

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

InChI

InChI=1S/C37H40N2O2/c1-27-34-24-33(40-26-30-12-6-3-7-13-30)21-22-36(34)39(37(27)31-14-8-4-9-15-31)25-29-17-19-32(20-18-29)41-28(2)35-16-10-5-11-23-38-35/h3-4,6-9,12-15,17-22,24,28,35,38H,5,10-11,16,23,25-26H2,1-2H3