(3R,4S)-N-[(E)-(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]-2-oxidanylidene-4-phenyl-pyrrolidine-3-carboxamide

Systemtic Name: (3R,4S)-N-[(E)-(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]-2-oxidanylidene-4-phenyl-pyrrolidine-3-carboxamide Openeye Name: (3R,4S)-N-[(E)-(6-nitro-1,3-benzodioxol-5-yl)methyleneamino]-2-oxo-4-phenyl-pyrrolidine-3-carboxamide CAS Name: (3R,4S)-N-[(E)-(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]-2-oxo-4-phenyl-3-pyrrolidinecarboxamide IUPAC Name: (3R,4S)-N-[(E)-(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]-2-oxo-4-phenylpyrrolidine-3-carboxamide Traditional Name: (3R,4S)-2-keto-N-[(E)-(6-nitro-1,3-benzodioxol-5-yl)methyleneamino]-4-phenyl-pyrrolidine-3-carboxamide Formula: C19H16N4O6 MolecularWeight: 396.35354

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(C(=O)N1)C(=O)NN=CC2=CC3=C(C=C2[N+](=O)[O-])OCO3)C4=CC=CC=C4

Isomeric SMILES

C1[C@@H]([C@H](C(=O)N1)C(=O)N/N=C/C2=CC3=C(C=C2[N+](=O)[O-])OCO3)C4=CC=CC=C4

InChI

InChI=1S/C19H16N4O6/c24-18-17(13(9-20-18)11-4-2-1-3-5-11)19(25)22-21-8-12-6-15-16(29-10-28-15)7-14(12)23(26)27/h1-8,13,17H,9-10H2,(H,20,24)(H,22,25)/b21-8+/t13-,17-/m1/s1