3-[2,3-bis(bromanyl)-5-methoxy-4-oxidanyl-phenyl]-2-(3-nitrophenyl)prop-2-enenitrile

Systemtic Name: 3-[2,3-bis(bromanyl)-5-methoxy-4-oxidanyl-phenyl]-2-(3-nitrophenyl)prop-2-enenitrile Openeye Name: 3-(2,3-dibromo-4-hydroxy-5-methoxy-phenyl)-2-(3-nitrophenyl)prop-2-enenitrile CAS Name: 3-(2,3-dibromo-4-hydroxy-5-methoxyphenyl)-2-(3-nitrophenyl)-2-propenenitrile IUPAC Name: 3-(2,3-dibromo-4-hydroxy-5-methoxyphenyl)-2-(3-nitrophenyl)prop-2-enenitrile Traditional Name: 3-(2,3-dibromo-4-hydroxy-5-methoxy-phenyl)-2-(3-nitrophenyl)acrylonitrile Formula: C16H10Br2N2O4 MolecularWeight: 454.0696

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C(=C1)C=C(C#N)C2=CC(=CC=C2)[N+](=O)[O-])Br)Br)O

Isomeric SMILES

COC1=C(C(=C(C(=C1)C=C(C#N)C2=CC(=CC=C2)[N+](=O)[O-])Br)Br)O

InChI

InChI=1S/C16H10Br2N2O4/c1-24-13-7-10(14(17)15(18)16(13)21)5-11(8-19)9-3-2-4-12(6-9)20(22)23/h2-7,21H,1H3