4-(1,3-benzodioxol-5-yl)-2-(4-nitrophenyl)-3-propyl-1,3-oxazolidine-5,5-dicarbonitrile

Systemtic Name: 4-(1,3-benzodioxol-5-yl)-2-(4-nitrophenyl)-3-propyl-1,3-oxazolidine-5,5-dicarbonitrile Openeye Name: 4-(1,3-benzodioxol-5-yl)-2-(4-nitrophenyl)-3-propyl-oxazolidine-5,5-dicarbonitrile CAS Name: 4-(1,3-benzodioxol-5-yl)-2-(4-nitrophenyl)-3-propyloxazolidine-5,5-dicarbonitrile IUPAC Name: 4-(1,3-benzodioxol-5-yl)-2-(4-nitrophenyl)-3-propyl-1,3-oxazolidine-5,5-dicarbonitrile Traditional Name: 4-(1,3-benzodioxol-5-yl)-2-(4-nitrophenyl)-3-propyl-oxazolidine-5,5-dicarbonitrile Formula: C21H18N4O5 MolecularWeight: 406.39142

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(C(OC1C2=CC=C(C=C2)[N+](=O)[O-])(C#N)C#N)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

CCCN1C(C(OC1C2=CC=C(C=C2)[N+](=O)[O-])(C#N)C#N)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C21H18N4O5/c1-2-9-24-19(15-5-8-17-18(10-15)29-13-28-17)21(11-22,12-23)30-20(24)14-3-6-16(7-4-14)25(26)27/h3-8,10,19-20H,2,9,13H2,1H3