(E)-3-[4-[(4-bromophenyl)methoxy]phenyl]-2-(3-nitrophenyl)carbonyl-prop-2-enenitrile

Systemtic Name: (E)-3-[4-[(4-bromophenyl)methoxy]phenyl]-2-(3-nitrophenyl)carbonyl-prop-2-enenitrile Openeye Name: (E)-3-[4-[(4-bromophenyl)methoxy]phenyl]-2-(3-nitrobenzoyl)prop-2-enenitrile CAS Name: (E)-3-[4-[(4-bromophenyl)methoxy]phenyl]-2-[(3-nitrophenyl)-oxomethyl]-2-propenenitrile IUPAC Name: (E)-3-[4-[(4-bromophenyl)methoxy]phenyl]-2-(3-nitrobenzoyl)prop-2-enenitrile Traditional Name: (E)-3-[4-(4-bromobenzyl)oxyphenyl]-2-(3-nitrobenzoyl)acrylonitrile Formula: C23H15BrN2O4 MolecularWeight: 463.2802

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)C(=CC2=CC=C(C=C2)OCC3=CC=C(C=C3)Br)C#N

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)/C(=C/C2=CC=C(C=C2)OCC3=CC=C(C=C3)Br)/C#N

InChI

InChI=1S/C23H15BrN2O4/c24-20-8-4-17(5-9-20)15-30-22-10-6-16(7-11-22)12-19(14-25)23(27)18-2-1-3-21(13-18)26(28)29/h1-13H,15H2/b19-12+