N-[3-(4-tert-butylphenyl)carbonylphenyl]-2-[methylsulfonyl-(3-nitrophenyl)amino]ethanamide

Systemtic Name: N-[3-(4-tert-butylphenyl)carbonylphenyl]-2-[methylsulfonyl-(3-nitrophenyl)amino]ethanamide Openeye Name: N-[3-(4-tert-butylbenzoyl)phenyl]-2-(N-methylsulfonyl-3-nitro-anilino)acetamide CAS Name: N-[3-[(4-tert-butylphenyl)-oxomethyl]phenyl]-2-(N-methylsulfonyl-3-nitroanilino)acetamide IUPAC Name: N-[3-(4-tert-butylbenzoyl)phenyl]-2-(N-methylsulfonyl-3-nitroanilino)acetamide Traditional Name: N-[3-(4-tert-butylbenzoyl)phenyl]-2-(N-mesyl-3-nitro-anilino)acetamide Formula: C26H27N3O6S MolecularWeight: 509.57408

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)C2=CC(=CC=C2)NC(=O)CN(C3=CC(=CC=C3)[N+](=O)[O-])S(=O)(=O)C

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)C2=CC(=CC=C2)NC(=O)CN(C3=CC(=CC=C3)[N+](=O)[O-])S(=O)(=O)C

InChI

InChI=1S/C26H27N3O6S/c1-26(2,3)20-13-11-18(12-14-20)25(31)19-7-5-8-21(15-19)27-24(30)17-28(36(4,34)35)22-9-6-10-23(16-22)29(32)33/h5-16H,17H2,1-4H3,(H,27,30)