(3Z,4S,5R)-5-nitro-3-(1-oxidanylethylidene)-4,6-diphenyl-hexan-2-one

Systemtic Name: (3Z,4S,5R)-5-nitro-3-(1-oxidanylethylidene)-4,6-diphenyl-hexan-2-one Openeye Name: (3Z,4S,5R)-3-(1-hydroxyethylidene)-5-nitro-4,6-diphenyl-hexan-2-one CAS Name: (3Z,4S,5R)-3-(1-hydroxyethylidene)-5-nitro-4,6-diphenyl-2-hexanone IUPAC Name: (3Z,4S,5R)-3-(1-hydroxyethylidene)-5-nitro-4,6-diphenylhexan-2-one Traditional Name: (Z)-4-hydroxy-3-[(1S,2R)-2-nitro-1,3-diphenyl-propyl]pent-3-en-2-one Formula: C20H21NO4 MolecularWeight: 339.38504

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C(C(C1=CC=CC=C1)C(CC2=CC=CC=C2)[N+](=O)[O-])C(=O)C)O

Isomeric SMILES

C/C(=C(\[C@H](C1=CC=CC=C1)[C@@H](CC2=CC=CC=C2)[N+](=O)[O-])/C(=O)C)/O

InChI

InChI=1S/C20H21NO4/c1-14(22)19(15(2)23)20(17-11-7-4-8-12-17)18(21(24)25)13-16-9-5-3-6-10-16/h3-12,18,20,22H,13H2,1-2H3/b19-14+/t18-,20-/m1/s1