N-butyl-4-morpholin-4-ylsulfonyl-2-nitro-aniline

Systemtic Name: N-butyl-4-morpholin-4-ylsulfonyl-2-nitro-aniline Openeye Name: N-butyl-4-morpholinosulfonyl-2-nitro-aniline CAS Name: N-butyl-4-(4-morpholinylsulfonyl)-2-nitroaniline IUPAC Name: N-butyl-4-morpholin-4-ylsulfonyl-2-nitroaniline Traditional Name: butyl-(4-morpholinosulfonyl-2-nitro-phenyl)amine Formula: C14H21N3O5S MolecularWeight: 343.39864

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)[N+](=O)[O-]

Isomeric SMILES

CCCCNC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)[N+](=O)[O-]

InChI

InChI=1S/C14H21N3O5S/c1-2-3-6-15-13-5-4-12(11-14(13)17(18)19)23(20,21)16-7-9-22-10-8-16/h4-5,11,15H,2-3,6-10H2,1H3