3-[(4-methoxyphenyl)methyl]-6-methylsulfonyl-1H-indole-2-carbonitrile

Systemtic Name: 3-[(4-methoxyphenyl)methyl]-6-methylsulfonyl-1H-indole-2-carbonitrile Openeye Name: 3-[(4-methoxyphenyl)methyl]-6-methylsulfonyl-1H-indole-2-carbonitrile CAS Name: 3-[(4-methoxyphenyl)methyl]-6-methylsulfonyl-1H-indole-2-carbonitrile IUPAC Name: 3-[(4-methoxyphenyl)methyl]-6-methylsulfonyl-1H-indole-2-carbonitrile Traditional Name: 6-mesyl-3-p-anisyl-1H-indole-2-carbonitrile Formula: C18H16N2O3S MolecularWeight: 340.39624

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CC2=C(NC3=C2C=CC(=C3)S(=O)(=O)C)C#N

Isomeric SMILES

COC1=CC=C(C=C1)CC2=C(NC3=C2C=CC(=C3)S(=O)(=O)C)C#N

InChI

InChI=1S/C18H16N2O3S/c1-23-13-5-3-12(4-6-13)9-16-15-8-7-14(24(2,21)22)10-17(15)20-18(16)11-19/h3-8,10,20H,9H2,1-2H3