N-[(6-methoxypyridin-3-yl)methyl]-4-(4-methylpiperidin-1-yl)sulfonyl-2-nitro-aniline

Systemtic Name: N-[(6-methoxypyridin-3-yl)methyl]-4-(4-methylpiperidin-1-yl)sulfonyl-2-nitro-aniline Openeye Name: N-[(6-methoxy-3-pyridyl)methyl]-4-[(4-methyl-1-piperidyl)sulfonyl]-2-nitro-aniline CAS Name: N-[(6-methoxy-3-pyridinyl)methyl]-4-[(4-methyl-1-piperidinyl)sulfonyl]-2-nitroaniline IUPAC Name: N-[(6-methoxypyridin-3-yl)methyl]-4-(4-methylpiperidin-1-yl)sulfonyl-2-nitroaniline Traditional Name: (6-methoxy-3-pyridyl)methyl-[4-(4-methylpiperidino)sulfonyl-2-nitro-phenyl]amine Formula: C19H24N4O5S MolecularWeight: 420.48266

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)NCC3=CN=C(C=C3)OC)[N+](=O)[O-]

Isomeric SMILES

CC1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)NCC3=CN=C(C=C3)OC)[N+](=O)[O-]

InChI

InChI=1S/C19H24N4O5S/c1-14-7-9-22(10-8-14)29(26,27)16-4-5-17(18(11-16)23(24)25)20-12-15-3-6-19(28-2)21-13-15/h3-6,11,13-14,20H,7-10,12H2,1-2H3