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

Systemtic Name: 2-[4-[(E)-3-[4-(dimethylamino)-3-nitro-phenyl]prop-2-enoyl]phenoxy]ethanenitrile Openeye Name: 2-[4-[(E)-3-[4-(dimethylamino)-3-nitro-phenyl]prop-2-enoyl]phenoxy]acetonitrile CAS Name: 2-[4-[(E)-3-[4-(dimethylamino)-3-nitrophenyl]-1-oxoprop-2-enyl]phenoxy]acetonitrile IUPAC Name: 2-[4-[(E)-3-[4-(dimethylamino)-3-nitrophenyl]prop-2-enoyl]phenoxy]acetonitrile Traditional Name: 2-[4-[(E)-3-[4-(dimethylamino)-3-nitro-phenyl]acryloyl]phenoxy]acetonitrile Formula: C19H17N3O4 MolecularWeight: 351.35598

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=C(C=C(C=C1)C=CC(=O)C2=CC=C(C=C2)OCC#N)[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C19H17N3O4/c1-21(2)17-9-3-14(13-18(17)22(24)25)4-10-19(23)15-5-7-16(8-6-15)26-12-11-20/h3-10,13H,12H2,1-2H3/b10-4+