2-(2-methoxyethylamino)-5-nitro-N-(3-piperidin-1-ylsulfonylphenyl)benzamide

Systemtic Name: 2-(2-methoxyethylamino)-5-nitro-N-(3-piperidin-1-ylsulfonylphenyl)benzamide Openeye Name: 2-(2-methoxyethylamino)-5-nitro-N-[3-(1-piperidylsulfonyl)phenyl]benzamide CAS Name: 2-(2-methoxyethylamino)-5-nitro-N-[3-(1-piperidinylsulfonyl)phenyl]benzamide IUPAC Name: 2-(2-methoxyethylamino)-5-nitro-N-(3-piperidin-1-ylsulfonylphenyl)benzamide Traditional Name: 2-(2-methoxyethylamino)-5-nitro-N-(3-piperidinosulfonylphenyl)benzamide Formula: C21H26N4O6S MolecularWeight: 462.51934

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Descriptors Computed from Structure

Canonical SMILES:

COCCNC1=C(C=C(C=C1)[N+](=O)[O-])C(=O)NC2=CC(=CC=C2)S(=O)(=O)N3CCCCC3

Isomeric SMILES

COCCNC1=C(C=C(C=C1)[N+](=O)[O-])C(=O)NC2=CC(=CC=C2)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C21H26N4O6S/c1-31-13-10-22-20-9-8-17(25(27)28)15-19(20)21(26)23-16-6-5-7-18(14-16)32(29,30)24-11-3-2-4-12-24/h5-9,14-15,22H,2-4,10-13H2,1H3,(H,23,26)