2-[methylsulfonyl-(3-nitrophenyl)amino]-N-[(2R)-4-phenylbutan-2-yl]ethanamide

Systemtic Name: 2-[methylsulfonyl-(3-nitrophenyl)amino]-N-[(2R)-4-phenylbutan-2-yl]ethanamide Openeye Name: N-[(1R)-1-methyl-3-phenyl-propyl]-2-(N-methylsulfonyl-3-nitro-anilino)acetamide CAS Name: 2-(N-methylsulfonyl-3-nitroanilino)-N-[(2R)-4-phenylbutan-2-yl]acetamide IUPAC Name: 2-(N-methylsulfonyl-3-nitroanilino)-N-[(2R)-4-phenylbutan-2-yl]acetamide Traditional Name: 2-(N-mesyl-3-nitro-anilino)-N-[(1R)-1-methyl-3-phenyl-propyl]acetamide Formula: C19H23N3O5S MolecularWeight: 405.46802

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC=CC=C1)NC(=O)CN(C2=CC(=CC=C2)[N+](=O)[O-])S(=O)(=O)C

Isomeric SMILES

C[C@H](CCC1=CC=CC=C1)NC(=O)CN(C2=CC(=CC=C2)[N+](=O)[O-])S(=O)(=O)C

InChI

InChI=1S/C19H23N3O5S/c1-15(11-12-16-7-4-3-5-8-16)20-19(23)14-21(28(2,26)27)17-9-6-10-18(13-17)22(24)25/h3-10,13,15H,11-12,14H2,1-2H3,(H,20,23)/t15-/m1/s1