ethyl (E)-3-ethyl-2-(4-nitrophenyl)-2-oxidanyl-hex-3-enoate

Systemtic Name: ethyl (E)-3-ethyl-2-(4-nitrophenyl)-2-oxidanyl-hex-3-enoate Openeye Name: ethyl (E)-3-ethyl-2-hydroxy-2-(4-nitrophenyl)hex-3-enoate CAS Name: (E)-3-ethyl-2-hydroxy-2-(4-nitrophenyl)-3-hexenoic acid ethyl ester IUPAC Name: ethyl (E)-3-ethyl-2-hydroxy-2-(4-nitrophenyl)hex-3-enoate Traditional Name: (E)-3-ethyl-2-hydroxy-2-(4-nitrophenyl)hex-3-enoic acid ethyl ester Formula: C16H21NO5 MolecularWeight: 307.34164

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H21NO5/c1-4-7-12(5-2)16(19,15(18)22-6-3)13-8-10-14(11-9-13)17(20)21/h7-11,19H,4-6H2,1-3H3/b12-7+