4-methylsulfonyl-2-nitro-N-(3-propan-2-ylphenyl)aniline

Systemtic Name: 4-methylsulfonyl-2-nitro-N-(3-propan-2-ylphenyl)aniline Openeye Name: N-(3-isopropylphenyl)-4-methylsulfonyl-2-nitro-aniline CAS Name: 4-methylsulfonyl-2-nitro-N-(3-propan-2-ylphenyl)aniline IUPAC Name: 4-methylsulfonyl-2-nitro-N-(3-propan-2-ylphenyl)aniline Traditional Name: m-cumenyl-(4-mesyl-2-nitro-phenyl)amine Formula: C16H18N2O4S MolecularWeight: 334.39012

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H18N2O4S/c1-11(2)12-5-4-6-13(9-12)17-15-8-7-14(23(3,21)22)10-16(15)18(19)20/h4-11,17H,1-3H3