(2S,3R)-2-(1,3-benzodioxol-5-yl)-1-(4-methoxyphenyl)-4-oxidanylidene-azetidine-3-carbonitrile

Systemtic Name: (2S,3R)-2-(1,3-benzodioxol-5-yl)-1-(4-methoxyphenyl)-4-oxidanylidene-azetidine-3-carbonitrile Openeye Name: (2S,3R)-2-(1,3-benzodioxol-5-yl)-1-(4-methoxyphenyl)-4-oxo-azetidine-3-carbonitrile CAS Name: (2S,3R)-2-(1,3-benzodioxol-5-yl)-1-(4-methoxyphenyl)-4-oxo-3-azetidinecarbonitrile IUPAC Name: (2S,3R)-2-(1,3-benzodioxol-5-yl)-1-(4-methoxyphenyl)-4-oxoazetidine-3-carbonitrile Traditional Name: (2S,3R)-2-(1,3-benzodioxol-5-yl)-4-keto-1-(4-methoxyphenyl)azetidine-3-carbonitrile Formula: C18H14N2O4 MolecularWeight: 322.31476

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C(C(C2=O)C#N)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

COC1=CC=C(C=C1)N2[C@@H]([C@@H](C2=O)C#N)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C18H14N2O4/c1-22-13-5-3-12(4-6-13)20-17(14(9-19)18(20)21)11-2-7-15-16(8-11)24-10-23-15/h2-8,14,17H,10H2,1H3/t14-,17+/m0/s1