ethyl 3-[(E,2Z)-2-hydroxyimino-5-nitro-hex-3-enyl]pyridine-4-carboxylate

Systemtic Name: ethyl 3-[(E,2Z)-2-hydroxyimino-5-nitro-hex-3-enyl]pyridine-4-carboxylate Openeye Name: ethyl 3-[(E,2Z)-2-hydroxyimino-5-nitro-hex-3-enyl]pyridine-4-carboxylate CAS Name: 3-[(E,2Z)-2-hydroxyimino-5-nitrohex-3-enyl]-4-pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 3-[(E,2Z)-2-hydroxyimino-5-nitrohex-3-enyl]pyridine-4-carboxylate Traditional Name: 3-[(E,2Z)-2-hydroximino-5-nitro-hex-3-enyl]isonicotinic acid ethyl ester Formula: C14H17N3O5 MolecularWeight: 307.30188

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=NC=C1)CC(=NO)C=CC(C)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=C(C=NC=C1)C/C(=N/O)/C=C/C(C)[N+](=O)[O-]

InChI

InChI=1S/C14H17N3O5/c1-3-22-14(18)13-6-7-15-9-11(13)8-12(16-19)5-4-10(2)17(20)21/h4-7,9-10,19H,3,8H2,1-2H3/b5-4+,16-12+