3-[3-ethoxy-4-[(4-methylphenyl)methoxy]phenyl]-2-(3-nitrophenyl)prop-2-enenitrile

Systemtic Name: 3-[3-ethoxy-4-[(4-methylphenyl)methoxy]phenyl]-2-(3-nitrophenyl)prop-2-enenitrile Openeye Name: 3-[3-ethoxy-4-(p-tolylmethoxy)phenyl]-2-(3-nitrophenyl)prop-2-enenitrile CAS Name: 3-[3-ethoxy-4-[(4-methylphenyl)methoxy]phenyl]-2-(3-nitrophenyl)-2-propenenitrile IUPAC Name: 3-[3-ethoxy-4-[(4-methylphenyl)methoxy]phenyl]-2-(3-nitrophenyl)prop-2-enenitrile Traditional Name: 3-[3-ethoxy-4-(4-methylbenzyl)oxy-phenyl]-2-(3-nitrophenyl)acrylonitrile Formula: C25H22N2O4 MolecularWeight: 414.45318

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C=C(C#N)C2=CC(=CC=C2)[N+](=O)[O-])OCC3=CC=C(C=C3)C

Isomeric SMILES

CCOC1=C(C=CC(=C1)C=C(C#N)C2=CC(=CC=C2)[N+](=O)[O-])OCC3=CC=C(C=C3)C

InChI

InChI=1S/C25H22N2O4/c1-3-30-25-14-20(11-12-24(25)31-17-19-9-7-18(2)8-10-19)13-22(16-26)21-5-4-6-23(15-21)27(28)29/h4-15H,3,17H2,1-2H3