7-[(1S)-2-[2-(methoxymethoxy)-5-nitro-phenyl]-1-oxidanyl-ethyl]naphthalene-2-carbonitrile

Systemtic Name: 7-[(1S)-2-[2-(methoxymethoxy)-5-nitro-phenyl]-1-oxidanyl-ethyl]naphthalene-2-carbonitrile Openeye Name: 7-[(1S)-1-hydroxy-2-[2-(methoxymethoxy)-5-nitro-phenyl]ethyl]naphthalene-2-carbonitrile CAS Name: 7-[(1S)-1-hydroxy-2-[2-(methoxymethoxy)-5-nitrophenyl]ethyl]-2-naphthalenecarbonitrile IUPAC Name: 7-[(1S)-1-hydroxy-2-[2-(methoxymethoxy)-5-nitrophenyl]ethyl]naphthalene-2-carbonitrile Traditional Name: 7-[(1S)-1-hydroxy-2-[2-(methoxymethoxy)-5-nitro-phenyl]ethyl]naphthalene-2-carbonitrile Formula: C21H18N2O5 MolecularWeight: 378.37802

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Descriptors Computed from Structure

Canonical SMILES:

COCOC1=C(C=C(C=C1)[N+](=O)[O-])CC(C2=CC3=C(C=CC(=C3)C#N)C=C2)O

Isomeric SMILES

COCOC1=C(C=C(C=C1)[N+](=O)[O-])C[C@@H](C2=CC3=C(C=CC(=C3)C#N)C=C2)O

InChI

InChI=1S/C21H18N2O5/c1-27-13-28-21-7-6-19(23(25)26)10-18(21)11-20(24)16-5-4-15-3-2-14(12-22)8-17(15)9-16/h2-10,20,24H,11,13H2,1H3/t20-/m0/s1