N-(2-methyl-1-phenyl-propyl)-4-methylsulfonyl-2-nitro-aniline

Systemtic Name: N-(2-methyl-1-phenyl-propyl)-4-methylsulfonyl-2-nitro-aniline Openeye Name: N-(2-methyl-1-phenyl-propyl)-4-methylsulfonyl-2-nitro-aniline CAS Name: N-(2-methyl-1-phenylpropyl)-4-methylsulfonyl-2-nitroaniline IUPAC Name: N-(2-methyl-1-phenylpropyl)-4-methylsulfonyl-2-nitroaniline Traditional Name: (4-mesyl-2-nitro-phenyl)-(2-methyl-1-phenyl-propyl)amine Formula: C17H20N2O4S MolecularWeight: 348.4167

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H20N2O4S/c1-12(2)17(13-7-5-4-6-8-13)18-15-10-9-14(24(3,22)23)11-16(15)19(20)21/h4-12,17-18H,1-3H3