N-[(2S)-1-(butylamino)-4-methyl-1-oxidanylidene-pentan-2-yl]-3,5-dinitro-benzamide

Systemtic Name: N-[(2S)-1-(butylamino)-4-methyl-1-oxidanylidene-pentan-2-yl]-3,5-dinitro-benzamide Openeye Name: N-[(1S)-1-(butylcarbamoyl)-3-methyl-butyl]-3,5-dinitro-benzamide CAS Name: N-[(2S)-1-(butylamino)-4-methyl-1-oxopentan-2-yl]-3,5-dinitrobenzamide IUPAC Name: N-[(2S)-1-(butylamino)-4-methyl-1-oxopentan-2-yl]-3,5-dinitrobenzamide Traditional Name: N-[(1S)-1-(butylcarbamoyl)-3-methyl-butyl]-3,5-dinitro-benzamide Formula: C17H24N4O6 MolecularWeight: 380.39566

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H24N4O6/c1-4-5-6-18-17(23)15(7-11(2)3)19-16(22)12-8-13(20(24)25)10-14(9-12)21(26)27/h8-11,15H,4-7H2,1-3H3,(H,18,23)(H,19,22)/t15-/m0/s1