2-[4-[(E)-3-(4-chloranyl-3-nitro-phenyl)prop-2-enoyl]phenoxy]ethanenitrile

Systemtic Name: 2-[4-[(E)-3-(4-chloranyl-3-nitro-phenyl)prop-2-enoyl]phenoxy]ethanenitrile Openeye Name: 2-[4-[(E)-3-(4-chloro-3-nitro-phenyl)prop-2-enoyl]phenoxy]acetonitrile CAS Name: 2-[4-[(E)-3-(4-chloro-3-nitrophenyl)-1-oxoprop-2-enyl]phenoxy]acetonitrile IUPAC Name: 2-[4-[(E)-3-(4-chloro-3-nitrophenyl)prop-2-enoyl]phenoxy]acetonitrile Traditional Name: 2-[4-[(E)-3-(4-chloro-3-nitro-phenyl)acryloyl]phenoxy]acetonitrile Formula: C17H11ClN2O4 MolecularWeight: 342.73324

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)C=CC2=CC(=C(C=C2)Cl)[N+](=O)[O-])OCC#N

Isomeric SMILES

C1=CC(=CC=C1C(=O)/C=C/C2=CC(=C(C=C2)Cl)[N+](=O)[O-])OCC#N

InChI

InChI=1S/C17H11ClN2O4/c18-15-7-1-12(11-16(15)20(22)23)2-8-17(21)13-3-5-14(6-4-13)24-10-9-19/h1-8,11H,10H2/b8-2+