(Z)-2-[(4-iodanyl-3,5-dipropoxy-phenyl)methyl]-3-phenylazanyl-prop-2-enenitrile

Systemtic Name: (Z)-2-[(4-iodanyl-3,5-dipropoxy-phenyl)methyl]-3-phenylazanyl-prop-2-enenitrile Openeye Name: (Z)-3-anilino-2-[(4-iodo-3,5-dipropoxy-phenyl)methyl]prop-2-enenitrile CAS Name: (Z)-3-anilino-2-[(4-iodo-3,5-dipropoxyphenyl)methyl]-2-propenenitrile IUPAC Name: (Z)-3-anilino-2-[(4-iodo-3,5-dipropoxyphenyl)methyl]prop-2-enenitrile Traditional Name: (Z)-3-anilino-2-(4-iodo-3,5-dipropoxy-benzyl)acrylonitrile Formula: C22H25IN2O2 MolecularWeight: 476.35057

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC(=CC(=C1I)OCCC)CC(=CNC2=CC=CC=C2)C#N

Isomeric SMILES

CCCOC1=CC(=CC(=C1I)OCCC)C/C(=C/NC2=CC=CC=C2)/C#N

InChI

InChI=1S/C22H25IN2O2/c1-3-10-26-20-13-17(14-21(22(20)23)27-11-4-2)12-18(15-24)16-25-19-8-6-5-7-9-19/h5-9,13-14,16,25H,3-4,10-12H2,1-2H3/b18-16-