(3aS,4S,9bS)-3a-nitro-4-phenyl-4,9b-dihydro-1H-chromeno[3,4-c]pyrazole

Systemtic Name: (3aS,4S,9bS)-3a-nitro-4-phenyl-4,9b-dihydro-1H-chromeno[3,4-c]pyrazole Openeye Name: (3aS,4S,9bS)-3a-nitro-4-phenyl-4,9b-dihydro-1H-chromeno[3,4-c]pyrazole CAS Name: (3aS,4S,9bS)-3a-nitro-4-phenyl-4,9b-dihydro-1H-[1]benzopyrano[3,4-c]pyrazole IUPAC Name: (3aS,4S,9bS)-3a-nitro-4-phenyl-4,9b-dihydro-1H-chromeno[3,4-c]pyrazole Traditional Name: (3aS,4S,9bS)-3a-nitro-4-phenyl-4,9b-dihydro-1H-chromeno[3,4-c]pyrazole Formula: C16H13N3O3 MolecularWeight: 295.29272

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Descriptors Computed from Structure

Canonical SMILES:

C1C2C3=CC=CC=C3OC(C2(N=N1)[N+](=O)[O-])C4=CC=CC=C4

Isomeric SMILES

C1[C@@H]2C3=CC=CC=C3O[C@H]([C@@]2(N=N1)[N+](=O)[O-])C4=CC=CC=C4

InChI

InChI=1S/C16H13N3O3/c20-19(21)16-13(10-17-18-16)12-8-4-5-9-14(12)22-15(16)11-6-2-1-3-7-11/h1-9,13,15H,10H2/t13-,15+,16+/m1/s1