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

Systemtic Name: 3-(6-ethoxy-1,3-benzodioxol-5-yl)-2-(3-nitrophenyl)prop-2-enenitrile Openeye Name: 3-(6-ethoxy-1,3-benzodioxol-5-yl)-2-(3-nitrophenyl)prop-2-enenitrile CAS Name: 3-(6-ethoxy-1,3-benzodioxol-5-yl)-2-(3-nitrophenyl)-2-propenenitrile IUPAC Name: 3-(6-ethoxy-1,3-benzodioxol-5-yl)-2-(3-nitrophenyl)prop-2-enenitrile Traditional Name: 3-(6-ethoxy-1,3-benzodioxol-5-yl)-2-(3-nitrophenyl)acrylonitrile Formula: C18H14N2O5 MolecularWeight: 338.31416

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1C=C(C#N)C3=CC(=CC=C3)[N+](=O)[O-])OCO2

Isomeric SMILES

CCOC1=CC2=C(C=C1C=C(C#N)C3=CC(=CC=C3)[N+](=O)[O-])OCO2

InChI

InChI=1S/C18H14N2O5/c1-2-23-16-9-18-17(24-11-25-18)8-13(16)6-14(10-19)12-4-3-5-15(7-12)20(21)22/h3-9H,2,11H2,1H3