2-[methylsulfonyl-(4-propan-2-ylphenyl)amino]-N-(3-nitrophenyl)ethanamide

Systemtic Name: 2-[methylsulfonyl-(4-propan-2-ylphenyl)amino]-N-(3-nitrophenyl)ethanamide Openeye Name: 2-(4-isopropyl-N-methylsulfonyl-anilino)-N-(3-nitrophenyl)acetamide CAS Name: 2-(N-methylsulfonyl-4-propan-2-ylanilino)-N-(3-nitrophenyl)acetamide IUPAC Name: 2-(N-methylsulfonyl-4-propan-2-ylanilino)-N-(3-nitrophenyl)acetamide Traditional Name: 2-(4-isopropyl-N-mesyl-anilino)-N-(3-nitrophenyl)acetamide Formula: C18H21N3O5S MolecularWeight: 391.44144

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H21N3O5S/c1-13(2)14-7-9-16(10-8-14)20(27(3,25)26)12-18(22)19-15-5-4-6-17(11-15)21(23)24/h4-11,13H,12H2,1-3H3,(H,19,22)