N-(3-cyclopentyloxypropyl)-2-[(3-nitrophenyl)-(phenylsulfonyl)amino]ethanamide

Systemtic Name: N-(3-cyclopentyloxypropyl)-2-[(3-nitrophenyl)-(phenylsulfonyl)amino]ethanamide Openeye Name: 2-[N-(benzenesulfonyl)-3-nitro-anilino]-N-[3-(cyclopentoxy)propyl]acetamide CAS Name: 2-[N-(benzenesulfonyl)-3-nitroanilino]-N-(3-cyclopentyloxypropyl)acetamide IUPAC Name: 2-[N-(benzenesulfonyl)-3-nitroanilino]-N-(3-cyclopentyloxypropyl)acetamide Traditional Name: 2-(N-besyl-3-nitro-anilino)-N-[3-(cyclopentoxy)propyl]acetamide Formula: C22H27N3O6S MolecularWeight: 461.53128

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)OCCCNC(=O)CN(C2=CC(=CC=C2)[N+](=O)[O-])S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

C1CCC(C1)OCCCNC(=O)CN(C2=CC(=CC=C2)[N+](=O)[O-])S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C22H27N3O6S/c26-22(23-14-7-15-31-20-10-4-5-11-20)17-24(18-8-6-9-19(16-18)25(27)28)32(29,30)21-12-2-1-3-13-21/h1-3,6,8-9,12-13,16,20H,4-5,7,10-11,14-15,17H2,(H,23,26)