4-(methylamino)-3-nitro-N-(3-piperidin-1-ylsulfonylphenyl)benzamide

Systemtic Name: 4-(methylamino)-3-nitro-N-(3-piperidin-1-ylsulfonylphenyl)benzamide Openeye Name: 4-(methylamino)-3-nitro-N-[3-(1-piperidylsulfonyl)phenyl]benzamide CAS Name: 4-(methylamino)-3-nitro-N-[3-(1-piperidinylsulfonyl)phenyl]benzamide IUPAC Name: 4-(methylamino)-3-nitro-N-(3-piperidin-1-ylsulfonylphenyl)benzamide Traditional Name: 4-(methylamino)-3-nitro-N-(3-piperidinosulfonylphenyl)benzamide Formula: C19H22N4O5S MolecularWeight: 418.46678

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CNC1=C(C=C(C=C1)C(=O)NC2=CC(=CC=C2)S(=O)(=O)N3CCCCC3)[N+](=O)[O-]

Isomeric SMILES

CNC1=C(C=C(C=C1)C(=O)NC2=CC(=CC=C2)S(=O)(=O)N3CCCCC3)[N+](=O)[O-]

InChI

InChI=1S/C19H22N4O5S/c1-20-17-9-8-14(12-18(17)23(25)26)19(24)21-15-6-5-7-16(13-15)29(27,28)22-10-3-2-4-11-22/h5-9,12-13,20H,2-4,10-11H2,1H3,(H,21,24)