(Z)-3-(7-methoxy-1,3-benzodioxol-5-yl)-2-(4-nitrophenyl)prop-2-enenitrile

Systemtic Name: (Z)-3-(7-methoxy-1,3-benzodioxol-5-yl)-2-(4-nitrophenyl)prop-2-enenitrile Openeye Name: (Z)-3-(7-methoxy-1,3-benzodioxol-5-yl)-2-(4-nitrophenyl)prop-2-enenitrile CAS Name: (Z)-3-(7-methoxy-1,3-benzodioxol-5-yl)-2-(4-nitrophenyl)-2-propenenitrile IUPAC Name: (Z)-3-(7-methoxy-1,3-benzodioxol-5-yl)-2-(4-nitrophenyl)prop-2-enenitrile Traditional Name: (Z)-3-(7-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=CC(=CC2=C1OCO2)C=C(C#N)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

COC1=CC(=CC2=C1OCO2)/C=C(\C#N)/C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H12N2O5/c1-22-15-7-11(8-16-17(15)24-10-23-16)6-13(9-18)12-2-4-14(5-3-12)19(20)21/h2-8H,10H2,1H3/b13-6+