(E)-2-cyano-N-(2-methoxyethyl)-3-(3-nitro-4-propan-2-yl-phenyl)prop-2-enamide

Systemtic Name: (E)-2-cyano-N-(2-methoxyethyl)-3-(3-nitro-4-propan-2-yl-phenyl)prop-2-enamide Openeye Name: (E)-2-cyano-3-(4-isopropyl-3-nitro-phenyl)-N-(2-methoxyethyl)prop-2-enamide CAS Name: (E)-2-cyano-N-(2-methoxyethyl)-3-(3-nitro-4-propan-2-ylphenyl)-2-propenamide IUPAC Name: (E)-2-cyano-N-(2-methoxyethyl)-3-(3-nitro-4-propan-2-ylphenyl)prop-2-enamide Traditional Name: (E)-2-cyano-3-(4-isopropyl-3-nitro-phenyl)-N-(2-methoxyethyl)acrylamide Formula: C16H19N3O4 MolecularWeight: 317.33976

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C=C(C=C1)C=C(C#N)C(=O)NCCOC)[N+](=O)[O-]

Isomeric SMILES

CC(C)C1=C(C=C(C=C1)/C=C(\C#N)/C(=O)NCCOC)[N+](=O)[O-]

InChI

InChI=1S/C16H19N3O4/c1-11(2)14-5-4-12(9-15(14)19(21)22)8-13(10-17)16(20)18-6-7-23-3/h4-5,8-9,11H,6-7H2,1-3H3,(H,18,20)/b13-8+