methyl 2-methyl-2-[4-[2-(5-phenylmethoxyindol-1-yl)ethoxy]phenyl]sulfanyl-propanoate

Systemtic Name: methyl 2-methyl-2-[4-[2-(5-phenylmethoxyindol-1-yl)ethoxy]phenyl]sulfanyl-propanoate Openeye Name: methyl 2-[4-[2-(5-benzyloxyindol-1-yl)ethoxy]phenyl]sulfanyl-2-methyl-propanoate CAS Name: 2-methyl-2-[[4-[2-(5-phenylmethoxy-1-indolyl)ethoxy]phenyl]thio]propanoic acid methyl ester IUPAC Name: methyl 2-methyl-2-[4-[2-(5-phenylmethoxyindol-1-yl)ethoxy]phenyl]sulfanylpropanoate Traditional Name: 2-[[4-[2-(5-benzoxyindol-1-yl)ethoxy]phenyl]thio]-2-methyl-propionic acid methyl ester Formula: C28H29NO4S MolecularWeight: 475.59916

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)OC)SC1=CC=C(C=C1)OCCN2C=CC3=C2C=CC(=C3)OCC4=CC=CC=C4

Isomeric SMILES

CC(C)(C(=O)OC)SC1=CC=C(C=C1)OCCN2C=CC3=C2C=CC(=C3)OCC4=CC=CC=C4

InChI

InChI=1S/C28H29NO4S/c1-28(2,27(30)31-3)34-25-12-9-23(10-13-25)32-18-17-29-16-15-22-19-24(11-14-26(22)29)33-20-21-7-5-4-6-8-21/h4-16,19H,17-18,20H2,1-3H3