N-[(2R)-1-methoxypropan-2-yl]-4-(4-methylpiperidin-1-yl)sulfonyl-2-nitro-aniline

Systemtic Name: N-[(2R)-1-methoxypropan-2-yl]-4-(4-methylpiperidin-1-yl)sulfonyl-2-nitro-aniline Openeye Name: N-[(1R)-2-methoxy-1-methyl-ethyl]-4-[(4-methyl-1-piperidyl)sulfonyl]-2-nitro-aniline CAS Name: N-[(2R)-1-methoxypropan-2-yl]-4-[(4-methyl-1-piperidinyl)sulfonyl]-2-nitroaniline IUPAC Name: N-[(2R)-1-methoxypropan-2-yl]-4-(4-methylpiperidin-1-yl)sulfonyl-2-nitroaniline Traditional Name: [(1R)-2-methoxy-1-methyl-ethyl]-[4-(4-methylpiperidino)sulfonyl-2-nitro-phenyl]amine Formula: C16H25N3O5S MolecularWeight: 371.4518

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)NC(C)COC)[N+](=O)[O-]

Isomeric SMILES

CC1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)N[C@H](C)COC)[N+](=O)[O-]

InChI

InChI=1S/C16H25N3O5S/c1-12-6-8-18(9-7-12)25(22,23)14-4-5-15(16(10-14)19(20)21)17-13(2)11-24-3/h4-5,10,12-13,17H,6-9,11H2,1-3H3/t13-/m1/s1