1-[(3-methoxyphenyl)methyl]-4-(4-methylsulfonyl-2-nitro-phenyl)piperazine

Systemtic Name: 1-[(3-methoxyphenyl)methyl]-4-(4-methylsulfonyl-2-nitro-phenyl)piperazine Openeye Name: 1-[(3-methoxyphenyl)methyl]-4-(4-methylsulfonyl-2-nitro-phenyl)piperazine CAS Name: 1-[(3-methoxyphenyl)methyl]-4-(4-methylsulfonyl-2-nitrophenyl)piperazine IUPAC Name: 1-[(3-methoxyphenyl)methyl]-4-(4-methylsulfonyl-2-nitrophenyl)piperazine Traditional Name: 1-m-anisyl-4-(4-mesyl-2-nitro-phenyl)piperazine Formula: C19H23N3O5S MolecularWeight: 405.46802

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CN2CCN(CC2)C3=C(C=C(C=C3)S(=O)(=O)C)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=CC(=C1)CN2CCN(CC2)C3=C(C=C(C=C3)S(=O)(=O)C)[N+](=O)[O-]

InChI

InChI=1S/C19H23N3O5S/c1-27-16-5-3-4-15(12-16)14-20-8-10-21(11-9-20)18-7-6-17(28(2,25)26)13-19(18)22(23)24/h3-7,12-13H,8-11,14H2,1-2H3