(E)-3-(dimethylamino)-2-[3-(4-nitrophenoxy)phenyl]carbonyl-prop-2-enenitrile

Systemtic Name: (E)-3-(dimethylamino)-2-[3-(4-nitrophenoxy)phenyl]carbonyl-prop-2-enenitrile Openeye Name: (E)-3-(dimethylamino)-2-[3-(4-nitrophenoxy)benzoyl]prop-2-enenitrile CAS Name: (E)-3-(dimethylamino)-2-[[3-(4-nitrophenoxy)phenyl]-oxomethyl]-2-propenenitrile IUPAC Name: (E)-3-(dimethylamino)-2-[3-(4-nitrophenoxy)benzoyl]prop-2-enenitrile Traditional Name: (E)-3-(dimethylamino)-2-[3-(4-nitrophenoxy)benzoyl]acrylonitrile Formula: C18H15N3O4 MolecularWeight: 337.3294

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C=C(C#N)C(=O)C1=CC(=CC=C1)OC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CN(C)/C=C(\C#N)/C(=O)C1=CC(=CC=C1)OC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C18H15N3O4/c1-20(2)12-14(11-19)18(22)13-4-3-5-17(10-13)25-16-8-6-15(7-9-16)21(23)24/h3-10,12H,1-2H3/b14-12+