methyl 3-cyclohexyl-2-[2-[2-(oxan-2-yloxy)ethylsulfanyl]phenyl]-1H-indole-6-carboxylate

Systemtic Name: methyl 3-cyclohexyl-2-[2-[2-(oxan-2-yloxy)ethylsulfanyl]phenyl]-1H-indole-6-carboxylate Openeye Name: methyl 3-cyclohexyl-2-[2-(2-tetrahydropyran-2-yloxyethylsulfanyl)phenyl]-1H-indole-6-carboxylate CAS Name: 3-cyclohexyl-2-[2-[2-(2-oxanyloxy)ethylthio]phenyl]-1H-indole-6-carboxylic acid methyl ester IUPAC Name: methyl 3-cyclohexyl-2-[2-[2-(oxan-2-yloxy)ethylsulfanyl]phenyl]-1H-indole-6-carboxylate Traditional Name: 3-cyclohexyl-2-[2-(2-tetrahydropyran-2-yloxyethylthio)phenyl]-1H-indole-6-carboxylic acid methyl ester Formula: C29H35NO4S MolecularWeight: 493.6575

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)C(=C(N2)C3=CC=CC=C3SCCOC4CCCCO4)C5CCCCC5

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)C(=C(N2)C3=CC=CC=C3SCCOC4CCCCO4)C5CCCCC5

InChI

InChI=1S/C29H35NO4S/c1-32-29(31)21-14-15-22-24(19-21)30-28(27(22)20-9-3-2-4-10-20)23-11-5-6-12-25(23)35-18-17-34-26-13-7-8-16-33-26/h5-6,11-12,14-15,19-20,26,30H,2-4,7-10,13,16-18H2,1H3