N-(3-morpholin-4-ylpropyl)-2-[(3-nitrophenyl)-(phenylsulfonyl)amino]ethanamide

Systemtic Name: N-(3-morpholin-4-ylpropyl)-2-[(3-nitrophenyl)-(phenylsulfonyl)amino]ethanamide Openeye Name: 2-[N-(benzenesulfonyl)-3-nitro-anilino]-N-(3-morpholinopropyl)acetamide CAS Name: 2-[N-(benzenesulfonyl)-3-nitroanilino]-N-[3-(4-morpholinyl)propyl]acetamide IUPAC Name: 2-[N-(benzenesulfonyl)-3-nitroanilino]-N-(3-morpholin-4-ylpropyl)acetamide Traditional Name: 2-(N-besyl-3-nitro-anilino)-N-(3-morpholinopropyl)acetamide Formula: C21H26N4O6S MolecularWeight: 462.51934

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCCNC(=O)CN(C2=CC(=CC=C2)[N+](=O)[O-])S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

C1COCCN1CCCNC(=O)CN(C2=CC(=CC=C2)[N+](=O)[O-])S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H26N4O6S/c26-21(22-10-5-11-23-12-14-31-15-13-23)17-24(18-6-4-7-19(16-18)25(27)28)32(29,30)20-8-2-1-3-9-20/h1-4,6-9,16H,5,10-15,17H2,(H,22,26)