N-[(1R)-1-(4-methylphenyl)propyl]-4-methylsulfonyl-2-nitro-aniline

Systemtic Name: N-[(1R)-1-(4-methylphenyl)propyl]-4-methylsulfonyl-2-nitro-aniline Openeye Name: 4-methylsulfonyl-2-nitro-N-[(1R)-1-(p-tolyl)propyl]aniline CAS Name: N-[(1R)-1-(4-methylphenyl)propyl]-4-methylsulfonyl-2-nitroaniline IUPAC Name: N-[(1R)-1-(4-methylphenyl)propyl]-4-methylsulfonyl-2-nitroaniline Traditional Name: (4-mesyl-2-nitro-phenyl)-[(1R)-1-(p-tolyl)propyl]amine Formula: C17H20N2O4S MolecularWeight: 348.4167

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=C(C=C1)C)NC2=C(C=C(C=C2)S(=O)(=O)C)[N+](=O)[O-]

Isomeric SMILES

CC[C@H](C1=CC=C(C=C1)C)NC2=C(C=C(C=C2)S(=O)(=O)C)[N+](=O)[O-]

InChI

InChI=1S/C17H20N2O4S/c1-4-15(13-7-5-12(2)6-8-13)18-16-10-9-14(24(3,22)23)11-17(16)19(20)21/h5-11,15,18H,4H2,1-3H3/t15-/m1/s1