3-(4-butan-2-yloxy-3-iodanyl-5-methoxy-phenyl)-2-(3-nitrophenyl)prop-2-enenitrile

Systemtic Name: 3-(4-butan-2-yloxy-3-iodanyl-5-methoxy-phenyl)-2-(3-nitrophenyl)prop-2-enenitrile Openeye Name: 3-(3-iodo-5-methoxy-4-sec-butoxy-phenyl)-2-(3-nitrophenyl)prop-2-enenitrile CAS Name: 3-(4-butan-2-yloxy-3-iodo-5-methoxyphenyl)-2-(3-nitrophenyl)-2-propenenitrile IUPAC Name: 3-(4-butan-2-yloxy-3-iodo-5-methoxyphenyl)-2-(3-nitrophenyl)prop-2-enenitrile Traditional Name: 3-(3-iodo-5-methoxy-4-sec-butoxy-phenyl)-2-(3-nitrophenyl)acrylonitrile Formula: C20H19IN2O4 MolecularWeight: 478.28033

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)OC1=C(C=C(C=C1I)C=C(C#N)C2=CC(=CC=C2)[N+](=O)[O-])OC

Isomeric SMILES

CCC(C)OC1=C(C=C(C=C1I)C=C(C#N)C2=CC(=CC=C2)[N+](=O)[O-])OC

InChI

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