diethyl (2E)-2-[(2-nitro-5-oxidanyl-phenyl)methylidene]butanedioate

Systemtic Name: diethyl (2E)-2-[(2-nitro-5-oxidanyl-phenyl)methylidene]butanedioate Openeye Name: diethyl (2E)-2-[(5-hydroxy-2-nitro-phenyl)methylene]butanedioate CAS Name: (2E)-2-[(5-hydroxy-2-nitrophenyl)methylidene]butanedioic acid diethyl ester IUPAC Name: diethyl (2E)-2-[(5-hydroxy-2-nitrophenyl)methylidene]butanedioate Traditional Name: (2E)-2-(5-hydroxy-2-nitro-benzylidene)succinic acid diethyl ester Formula: C15H17NO7 MolecularWeight: 323.29798

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(=CC1=C(C=CC(=C1)O)[N+](=O)[O-])C(=O)OCC

Isomeric SMILES

CCOC(=O)C/C(=C\C1=C(C=CC(=C1)O)[N+](=O)[O-])/C(=O)OCC

InChI

InChI=1S/C15H17NO7/c1-3-22-14(18)9-11(15(19)23-4-2)7-10-8-12(17)5-6-13(10)16(20)21/h5-8,17H,3-4,9H2,1-2H3/b11-7+