4-methylsulfonyl-2-nitro-1-(3-propan-2-ylphenoxy)benzene

Systemtic Name: 4-methylsulfonyl-2-nitro-1-(3-propan-2-ylphenoxy)benzene Openeye Name: 1-(3-isopropylphenoxy)-4-methylsulfonyl-2-nitro-benzene CAS Name: 4-methylsulfonyl-2-nitro-1-(3-propan-2-ylphenoxy)benzene IUPAC Name: 4-methylsulfonyl-2-nitro-1-(3-propan-2-ylphenoxy)benzene Traditional Name: 1-(3-isopropylphenoxy)-4-mesyl-2-nitro-benzene Formula: C16H17NO5S MolecularWeight: 335.37488

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=CC=C1)OC2=C(C=C(C=C2)S(=O)(=O)C)[N+](=O)[O-]

Isomeric SMILES

CC(C)C1=CC(=CC=C1)OC2=C(C=C(C=C2)S(=O)(=O)C)[N+](=O)[O-]

InChI

InChI=1S/C16H17NO5S/c1-11(2)12-5-4-6-13(9-12)22-16-8-7-14(23(3,20)21)10-15(16)17(18)19/h4-11H,1-3H3