3-(3-bromanyl-5-ethoxy-4-prop-2-ynoxy-phenyl)-2-(3-nitrophenyl)prop-2-enenitrile

Systemtic Name: 3-(3-bromanyl-5-ethoxy-4-prop-2-ynoxy-phenyl)-2-(3-nitrophenyl)prop-2-enenitrile Openeye Name: 3-(3-bromo-5-ethoxy-4-prop-2-ynoxy-phenyl)-2-(3-nitrophenyl)prop-2-enenitrile CAS Name: 3-(3-bromo-5-ethoxy-4-prop-2-ynoxyphenyl)-2-(3-nitrophenyl)-2-propenenitrile IUPAC Name: 3-(3-bromo-5-ethoxy-4-prop-2-ynoxyphenyl)-2-(3-nitrophenyl)prop-2-enenitrile Traditional Name: 3-(3-bromo-5-ethoxy-4-propargyloxy-phenyl)-2-(3-nitrophenyl)acrylonitrile Formula: C20H15BrN2O4 MolecularWeight: 427.2481

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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)OCC#C

Isomeric SMILES

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

InChI

InChI=1S/C20H15BrN2O4/c1-3-8-27-20-18(21)10-14(11-19(20)26-4-2)9-16(13-22)15-6-5-7-17(12-15)23(24)25/h1,5-7,9-12H,4,8H2,2H3