(2S)-2-[[2-(tert-butylamino)-2-oxidanylidene-ethyl]-methyl-amino]-N-(4-methyl-2-nitro-phenyl)-2-phenyl-ethanamide

Systemtic Name: (2S)-2-[[2-(tert-butylamino)-2-oxidanylidene-ethyl]-methyl-amino]-N-(4-methyl-2-nitro-phenyl)-2-phenyl-ethanamide Openeye Name: (2S)-2-[[2-(tert-butylamino)-2-oxo-ethyl]-methyl-amino]-N-(4-methyl-2-nitro-phenyl)-2-phenyl-acetamide CAS Name: (2S)-2-[[2-(tert-butylamino)-2-oxoethyl]-methylamino]-N-(4-methyl-2-nitrophenyl)-2-phenylacetamide IUPAC Name: (2S)-2-[[2-(tert-butylamino)-2-oxoethyl]-methylamino]-N-(4-methyl-2-nitrophenyl)-2-phenylacetamide Traditional Name: (2S)-2-[[2-(tert-butylamino)-2-keto-ethyl]-methyl-amino]-N-(4-methyl-2-nitro-phenyl)-2-phenyl-acetamide Formula: C22H28N4O4 MolecularWeight: 412.48212

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)C(C2=CC=CC=C2)N(C)CC(=O)NC(C)(C)C)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)[C@H](C2=CC=CC=C2)N(C)CC(=O)NC(C)(C)C)[N+](=O)[O-]

InChI

InChI=1S/C22H28N4O4/c1-15-11-12-17(18(13-15)26(29)30)23-21(28)20(16-9-7-6-8-10-16)25(5)14-19(27)24-22(2,3)4/h6-13,20H,14H2,1-5H3,(H,23,28)(H,24,27)/t20-/m0/s1