N-[(2S)-3-methylbutan-2-yl]-4-morpholin-4-ylsulfonyl-2-nitro-aniline

Systemtic Name: N-[(2S)-3-methylbutan-2-yl]-4-morpholin-4-ylsulfonyl-2-nitro-aniline Openeye Name: N-[(1S)-1,2-dimethylpropyl]-4-morpholinosulfonyl-2-nitro-aniline CAS Name: N-[(2S)-3-methylbutan-2-yl]-4-(4-morpholinylsulfonyl)-2-nitroaniline IUPAC Name: N-[(2S)-3-methylbutan-2-yl]-4-morpholin-4-ylsulfonyl-2-nitroaniline Traditional Name: [(1S)-1,2-dimethylpropyl]-(4-morpholinosulfonyl-2-nitro-phenyl)amine Formula: C15H23N3O5S MolecularWeight: 357.42522

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C)NC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)[N+](=O)[O-]

Isomeric SMILES

C[C@@H](C(C)C)NC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)[N+](=O)[O-]

InChI

InChI=1S/C15H23N3O5S/c1-11(2)12(3)16-14-5-4-13(10-15(14)18(19)20)24(21,22)17-6-8-23-9-7-17/h4-5,10-12,16H,6-9H2,1-3H3/t12-/m0/s1