3-[3-bromanyl-5-ethoxy-4-[(3-methylphenyl)methoxy]phenyl]-2-(3-nitrophenyl)prop-2-enenitrile

Systemtic Name: 3-[3-bromanyl-5-ethoxy-4-[(3-methylphenyl)methoxy]phenyl]-2-(3-nitrophenyl)prop-2-enenitrile Openeye Name: 3-[3-bromo-5-ethoxy-4-(m-tolylmethoxy)phenyl]-2-(3-nitrophenyl)prop-2-enenitrile CAS Name: 3-[3-bromo-5-ethoxy-4-[(3-methylphenyl)methoxy]phenyl]-2-(3-nitrophenyl)-2-propenenitrile IUPAC Name: 3-[3-bromo-5-ethoxy-4-[(3-methylphenyl)methoxy]phenyl]-2-(3-nitrophenyl)prop-2-enenitrile Traditional Name: 3-[3-bromo-5-ethoxy-4-(3-methylbenzyl)oxy-phenyl]-2-(3-nitrophenyl)acrylonitrile Formula: C25H21BrN2O4 MolecularWeight: 493.34924

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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-])Br)OCC3=CC=CC(=C3)C

Isomeric SMILES

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

InChI

InChI=1S/C25H21BrN2O4/c1-3-31-24-13-19(11-21(15-27)20-8-5-9-22(14-20)28(29)30)12-23(26)25(24)32-16-18-7-4-6-17(2)10-18/h4-14H,3,16H2,1-2H3