(1S,2S)-N2-(3-nitrophenyl)-N1-prop-2-enyl-cyclohex-4-ene-1,2-dicarboxamide

Systemtic Name: (1S,2S)-N2-(3-nitrophenyl)-N1-prop-2-enyl-cyclohex-4-ene-1,2-dicarboxamide Openeye Name: (1S,2S)-N1-allyl-N2-(3-nitrophenyl)cyclohex-4-ene-1,2-dicarboxamide CAS Name: (1S,2S)-N2-(3-nitrophenyl)-N1-prop-2-enylcyclohex-4-ene-1,2-dicarboxamide IUPAC Name: (1S,2S)-2-N-(3-nitrophenyl)-1-N-prop-2-enylcyclohex-4-ene-1,2-dicarboxamide Traditional Name: (1S,2S)-N-allyl-N'-(3-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/c1-2-10-18-16(21)14-8-3-4-9-15(14)17(22)19-12-6-5-7-13(11-12)20(23)24/h2-7,11,14-15H,1,8-10H2,(H,18,21)(H,19,22)/t14-,15-/m0/s1