N-(2-methoxy-5-nitro-phenyl)-2-(4-pyridin-3-ylsulfonylpiperazin-1-yl)propanamide

Systemtic Name: N-(2-methoxy-5-nitro-phenyl)-2-(4-pyridin-3-ylsulfonylpiperazin-1-yl)propanamide Openeye Name: N-(2-methoxy-5-nitro-phenyl)-2-[4-(3-pyridylsulfonyl)piperazin-1-yl]propanamide CAS Name: N-(2-methoxy-5-nitrophenyl)-2-[4-(3-pyridinylsulfonyl)-1-piperazinyl]propanamide IUPAC Name: N-(2-methoxy-5-nitrophenyl)-2-(4-pyridin-3-ylsulfonylpiperazin-1-yl)propanamide Traditional Name: N-(2-methoxy-5-nitro-phenyl)-2-[4-(3-pyridylsulfonyl)piperazino]propionamide Formula: C19H23N5O6S MolecularWeight: 449.48082

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C=CC(=C1)[N+](=O)[O-])OC)N2CCN(CC2)S(=O)(=O)C3=CN=CC=C3

Isomeric SMILES

CC(C(=O)NC1=C(C=CC(=C1)[N+](=O)[O-])OC)N2CCN(CC2)S(=O)(=O)C3=CN=CC=C3

InChI

InChI=1S/C19H23N5O6S/c1-14(19(25)21-17-12-15(24(26)27)5-6-18(17)30-2)22-8-10-23(11-9-22)31(28,29)16-4-3-7-20-13-16/h3-7,12-14H,8-11H2,1-2H3,(H,21,25)