3-(6-methoxy-1,3-benzodioxol-5-yl)-2-(4-nitrophenyl)prop-2-enenitrile

Systemtic Name: 3-(6-methoxy-1,3-benzodioxol-5-yl)-2-(4-nitrophenyl)prop-2-enenitrile Openeye Name: 3-(6-methoxy-1,3-benzodioxol-5-yl)-2-(4-nitrophenyl)prop-2-enenitrile CAS Name: 3-(6-methoxy-1,3-benzodioxol-5-yl)-2-(4-nitrophenyl)-2-propenenitrile IUPAC Name: 3-(6-methoxy-1,3-benzodioxol-5-yl)-2-(4-nitrophenyl)prop-2-enenitrile Traditional Name: 3-(6-methoxy-1,3-benzodioxol-5-yl)-2-(4-nitrophenyl)acrylonitrile Formula: C17H12N2O5 MolecularWeight: 324.28758

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1C=C(C#N)C3=CC=C(C=C3)[N+](=O)[O-])OCO2

Isomeric SMILES

COC1=CC2=C(C=C1C=C(C#N)C3=CC=C(C=C3)[N+](=O)[O-])OCO2

InChI

InChI=1S/C17H12N2O5/c1-22-15-8-17-16(23-10-24-17)7-12(15)6-13(9-18)11-2-4-14(5-3-11)19(20)21/h2-8H,10H2,1H3