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

Systemtic Name: N-(3-morpholin-4-ylpropyl)-2-[(4-nitrophenyl)-(phenylsulfonyl)amino]ethanamide Openeye Name: 2-[N-(benzenesulfonyl)-4-nitro-anilino]-N-(3-morpholinopropyl)acetamide CAS Name: 2-[N-(benzenesulfonyl)-4-nitroanilino]-N-[3-(4-morpholinyl)propyl]acetamide IUPAC Name: 2-[N-(benzenesulfonyl)-4-nitroanilino]-N-(3-morpholin-4-ylpropyl)acetamide Traditional Name: 2-(N-besyl-4-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=C(C=C2)[N+](=O)[O-])S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

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

InChI

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