N-[2-[[(2S)-2-(dimethylamino)-2-phenyl-ethyl]amino]-2-oxidanylidene-ethyl]-3-nitro-benzamide

Systemtic Name: N-[2-[[(2S)-2-(dimethylamino)-2-phenyl-ethyl]amino]-2-oxidanylidene-ethyl]-3-nitro-benzamide Openeye Name: N-[2-[[(2S)-2-(dimethylamino)-2-phenyl-ethyl]amino]-2-oxo-ethyl]-3-nitro-benzamide CAS Name: N-[2-[[(2S)-2-(dimethylamino)-2-phenylethyl]amino]-2-oxoethyl]-3-nitrobenzamide IUPAC Name: N-[2-[[(2S)-2-(dimethylamino)-2-phenylethyl]amino]-2-oxoethyl]-3-nitrobenzamide Traditional Name: N-[2-[[(2S)-2-(dimethylamino)-2-phenyl-ethyl]amino]-2-keto-ethyl]-3-nitro-benzamide Formula: C19H22N4O4 MolecularWeight: 370.40238

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(CNC(=O)CNC(=O)C1=CC(=CC=C1)[N+](=O)[O-])C2=CC=CC=C2

Isomeric SMILES

CN(C)[C@H](CNC(=O)CNC(=O)C1=CC(=CC=C1)[N+](=O)[O-])C2=CC=CC=C2

InChI

InChI=1S/C19H22N4O4/c1-22(2)17(14-7-4-3-5-8-14)12-20-18(24)13-21-19(25)15-9-6-10-16(11-15)23(26)27/h3-11,17H,12-13H2,1-2H3,(H,20,24)(H,21,25)/t17-/m1/s1