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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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