3-(3-ethoxy-5-iodanyl-4-propan-2-yloxy-phenyl)-2-(3-nitrophenyl)prop-2-enenitrile

Systemtic Name: 3-(3-ethoxy-5-iodanyl-4-propan-2-yloxy-phenyl)-2-(3-nitrophenyl)prop-2-enenitrile Openeye Name: 3-(3-ethoxy-5-iodo-4-isopropoxy-phenyl)-2-(3-nitrophenyl)prop-2-enenitrile CAS Name: 3-(3-ethoxy-5-iodo-4-propan-2-yloxyphenyl)-2-(3-nitrophenyl)-2-propenenitrile IUPAC Name: 3-(3-ethoxy-5-iodo-4-propan-2-yloxyphenyl)-2-(3-nitrophenyl)prop-2-enenitrile Traditional Name: 3-(3-ethoxy-5-iodo-4-isopropoxy-phenyl)-2-(3-nitrophenyl)acrylonitrile Formula: C20H19IN2O4 MolecularWeight: 478.28033

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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-])I)OC(C)C

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C=C(C#N)C2=CC(=CC=C2)[N+](=O)[O-])I)OC(C)C

InChI

InChI=1S/C20H19IN2O4/c1-4-26-19-10-14(9-18(21)20(19)27-13(2)3)8-16(12-22)15-6-5-7-17(11-15)23(24)25/h5-11,13H,4H2,1-3H3