N-[(2S)-1-[[4-(diethylcarbamoyl)phenyl]amino]-1-oxidanylidene-propan-2-yl]-3-nitro-benzamide

Systemtic Name: N-[(2S)-1-[[4-(diethylcarbamoyl)phenyl]amino]-1-oxidanylidene-propan-2-yl]-3-nitro-benzamide Openeye Name: N-[(1S)-2-[4-(diethylcarbamoyl)anilino]-1-methyl-2-oxo-ethyl]-3-nitro-benzamide CAS Name: N-[(2S)-1-[4-[diethylamino(oxo)methyl]anilino]-1-oxopropan-2-yl]-3-nitrobenzamide IUPAC Name: N-[(2S)-1-[4-(diethylcarbamoyl)anilino]-1-oxopropan-2-yl]-3-nitrobenzamide Traditional Name: N-[(1S)-2-[4-(diethylcarbamoyl)anilino]-2-keto-1-methyl-ethyl]-3-nitro-benzamide Formula: C21H24N4O5 MolecularWeight: 412.43906

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H24N4O5/c1-4-24(5-2)21(28)15-9-11-17(12-10-15)23-19(26)14(3)22-20(27)16-7-6-8-18(13-16)25(29)30/h6-14H,4-5H2,1-3H3,(H,22,27)(H,23,26)/t14-/m0/s1