3-[[4-[5-(methoxymethyl)-2-sulfanylidene-1,3-oxazolidin-3-yl]phenoxy]methyl]-5-nitro-benzenecarbonitrile

Systemtic Name: 3-[[4-[5-(methoxymethyl)-2-sulfanylidene-1,3-oxazolidin-3-yl]phenoxy]methyl]-5-nitro-benzenecarbonitrile Openeye Name: 3-[[4-[5-(methoxymethyl)-2-thioxo-oxazolidin-3-yl]phenoxy]methyl]-5-nitro-benzonitrile CAS Name: 3-[[4-[5-(methoxymethyl)-2-sulfanylidene-3-oxazolidinyl]phenoxy]methyl]-5-nitrobenzonitrile IUPAC Name: 3-[[4-[5-(methoxymethyl)-2-sulfanylidene-1,3-oxazolidin-3-yl]phenoxy]methyl]-5-nitrobenzonitrile Traditional Name: 3-[[4-[5-(methoxymethyl)-2-thioxo-oxazolidin-3-yl]phenoxy]methyl]-5-nitro-benzonitrile Formula: C19H17N3O5S MolecularWeight: 399.42038

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Descriptors Computed from Structure

Canonical SMILES:

COCC1CN(C(=S)O1)C2=CC=C(C=C2)OCC3=CC(=CC(=C3)C#N)[N+](=O)[O-]

Isomeric SMILES

COCC1CN(C(=S)O1)C2=CC=C(C=C2)OCC3=CC(=CC(=C3)C#N)[N+](=O)[O-]

InChI

InChI=1S/C19H17N3O5S/c1-25-12-18-10-21(19(28)27-18)15-2-4-17(5-3-15)26-11-14-6-13(9-20)7-16(8-14)22(23)24/h2-8,18H,10-12H2,1H3