2-[(2-methylphenyl)-methylsulfonyl-amino]-N-[2-[(2-nitrophenyl)amino]ethyl]ethanamide

Systemtic Name: 2-[(2-methylphenyl)-methylsulfonyl-amino]-N-[2-[(2-nitrophenyl)amino]ethyl]ethanamide Openeye Name: 2-(2-methyl-N-methylsulfonyl-anilino)-N-[2-(2-nitroanilino)ethyl]acetamide CAS Name: 2-(2-methyl-N-methylsulfonylanilino)-N-[2-(2-nitroanilino)ethyl]acetamide IUPAC Name: 2-(2-methyl-N-methylsulfonylanilino)-N-[2-(2-nitroanilino)ethyl]acetamide Traditional Name: 2-(N-mesyl-2-methyl-anilino)-N-[2-(2-nitroanilino)ethyl]acetamide Formula: C18H22N4O5S MolecularWeight: 406.45608

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N(CC(=O)NCCNC2=CC=CC=C2[N+](=O)[O-])S(=O)(=O)C

Isomeric SMILES

CC1=CC=CC=C1N(CC(=O)NCCNC2=CC=CC=C2[N+](=O)[O-])S(=O)(=O)C

InChI

InChI=1S/C18H22N4O5S/c1-14-7-3-5-9-16(14)21(28(2,26)27)13-18(23)20-12-11-19-15-8-4-6-10-17(15)22(24)25/h3-10,19H,11-13H2,1-2H3,(H,20,23)