N-(2-methoxyphenyl)-5-nitro-2-(pentan-3-ylamino)benzenesulfonamide

Systemtic Name: N-(2-methoxyphenyl)-5-nitro-2-(pentan-3-ylamino)benzenesulfonamide Openeye Name: 2-(1-ethylpropylamino)-N-(2-methoxyphenyl)-5-nitro-benzenesulfonamide CAS Name: N-(2-methoxyphenyl)-5-nitro-2-(pentan-3-ylamino)benzenesulfonamide IUPAC Name: N-(2-methoxyphenyl)-5-nitro-2-(pentan-3-ylamino)benzenesulfonamide Traditional Name: 2-(1-ethylpropylamino)-N-(2-methoxyphenyl)-5-nitro-benzenesulfonamide Formula: C18H23N3O5S MolecularWeight: 393.45732

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)NC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)NC2=CC=CC=C2OC

Isomeric SMILES

CCC(CC)NC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)NC2=CC=CC=C2OC

InChI

InChI=1S/C18H23N3O5S/c1-4-13(5-2)19-16-11-10-14(21(22)23)12-18(16)27(24,25)20-15-8-6-7-9-17(15)26-3/h6-13,19-20H,4-5H2,1-3H3