(1S,2S)-N2-(2-nitrophenyl)-N1-prop-2-enyl-cyclohex-4-ene-1,2-dicarboxamide

Systemtic Name: (1S,2S)-N2-(2-nitrophenyl)-N1-prop-2-enyl-cyclohex-4-ene-1,2-dicarboxamide Openeye Name: (1S,2S)-N1-allyl-N2-(2-nitrophenyl)cyclohex-4-ene-1,2-dicarboxamide CAS Name: (1S,2S)-N2-(2-nitrophenyl)-N1-prop-2-enylcyclohex-4-ene-1,2-dicarboxamide IUPAC Name: (1S,2S)-2-N-(2-nitrophenyl)-1-N-prop-2-enylcyclohex-4-ene-1,2-dicarboxamide Traditional Name: (1S,2S)-N-allyl-N'-(2-nitrophenyl)cyclohex-4-ene-1,2-dicarboxamide Formula: C17H19N3O4 MolecularWeight: 329.35046

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=O)C1CC=CCC1C(=O)NC2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

C=CCNC(=O)[C@H]1CC=CC[C@@H]1C(=O)NC2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C17H19N3O4/c1-2-11-18-16(21)12-7-3-4-8-13(12)17(22)19-14-9-5-6-10-15(14)20(23)24/h2-6,9-10,12-13H,1,7-8,11H2,(H,18,21)(H,19,22)/t12-,13-/m0/s1