N-[1-(4-tert-butylphenyl)ethyl]-2-[(3-nitrophenyl)-(phenylsulfonyl)amino]ethanamide

Systemtic Name: N-[1-(4-tert-butylphenyl)ethyl]-2-[(3-nitrophenyl)-(phenylsulfonyl)amino]ethanamide Openeye Name: 2-[N-(benzenesulfonyl)-3-nitro-anilino]-N-[1-(4-tert-butylphenyl)ethyl]acetamide CAS Name: 2-[N-(benzenesulfonyl)-3-nitroanilino]-N-[1-(4-tert-butylphenyl)ethyl]acetamide IUPAC Name: 2-[N-(benzenesulfonyl)-3-nitroanilino]-N-[1-(4-tert-butylphenyl)ethyl]acetamide Traditional Name: 2-(N-besyl-3-nitro-anilino)-N-[1-(4-tert-butylphenyl)ethyl]acetamide Formula: C26H29N3O5S MolecularWeight: 495.59056

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H29N3O5S/c1-19(20-13-15-21(16-14-20)26(2,3)4)27-25(30)18-28(22-9-8-10-23(17-22)29(31)32)35(33,34)24-11-6-5-7-12-24/h5-17,19H,18H2,1-4H3,(H,27,30)