2-methoxyethyl (E)-2-cyano-3-(3-methoxy-5-nitro-4-oxidanyl-phenyl)prop-2-enoate

Systemtic Name: 2-methoxyethyl (E)-2-cyano-3-(3-methoxy-5-nitro-4-oxidanyl-phenyl)prop-2-enoate Openeye Name: 2-methoxyethyl (E)-2-cyano-3-(4-hydroxy-3-methoxy-5-nitro-phenyl)prop-2-enoate CAS Name: (E)-2-cyano-3-(4-hydroxy-3-methoxy-5-nitrophenyl)-2-propenoic acid 2-methoxyethyl ester IUPAC Name: 2-methoxyethyl (E)-2-cyano-3-(4-hydroxy-3-methoxy-5-nitrophenyl)prop-2-enoate Traditional Name: (E)-2-cyano-3-(4-hydroxy-3-methoxy-5-nitro-phenyl)acrylic acid 2-methoxyethyl ester Formula: C14H14N2O7 MolecularWeight: 322.27016

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Descriptors Computed from Structure

Canonical SMILES:

COCCOC(=O)C(=CC1=CC(=C(C(=C1)OC)O)[N+](=O)[O-])C#N

Isomeric SMILES

COCCOC(=O)/C(=C/C1=CC(=C(C(=C1)OC)O)[N+](=O)[O-])/C#N

InChI

InChI=1S/C14H14N2O7/c1-21-3-4-23-14(18)10(8-15)5-9-6-11(16(19)20)13(17)12(7-9)22-2/h5-7,17H,3-4H2,1-2H3/b10-5+