N-[(1R,2R)-7-cyano-3,3-dimethyl-2-oxidanyl-4-oxidanylidene-1,2-dihydronaphthalen-1-yl]-4-nitro-benzamide

Systemtic Name: N-[(1R,2R)-7-cyano-3,3-dimethyl-2-oxidanyl-4-oxidanylidene-1,2-dihydronaphthalen-1-yl]-4-nitro-benzamide Openeye Name: N-[(1R,2R)-7-cyano-2-hydroxy-3,3-dimethyl-4-oxo-tetralin-1-yl]-4-nitro-benzamide CAS Name: N-[(1R,2R)-7-cyano-2-hydroxy-3,3-dimethyl-4-oxo-1,2-dihydronaphthalen-1-yl]-4-nitrobenzamide IUPAC Name: N-[(1R,2R)-7-cyano-2-hydroxy-3,3-dimethyl-4-oxo-1,2-dihydronaphthalen-1-yl]-4-nitrobenzamide Traditional Name: N-[(1R,2R)-7-cyano-2-hydroxy-4-keto-3,3-dimethyl-tetralin-1-yl]-4-nitro-benzamide Formula: C20H17N3O5 MolecularWeight: 379.36608

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C(C2=C(C1=O)C=CC(=C2)C#N)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-])O)C

Isomeric SMILES

CC1([C@H]([C@@H](C2=C(C1=O)C=CC(=C2)C#N)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-])O)C

InChI

InChI=1S/C20H17N3O5/c1-20(2)17(24)14-8-3-11(10-21)9-15(14)16(18(20)25)22-19(26)12-4-6-13(7-5-12)23(27)28/h3-9,16,18,25H,1-2H3,(H,22,26)/t16-,18+/m1/s1