ethyl 3-(3-nitro-4-oxidanyl-phenyl)-2-phenoxy-propanoate

Systemtic Name: ethyl 3-(3-nitro-4-oxidanyl-phenyl)-2-phenoxy-propanoate Openeye Name: ethyl 3-(4-hydroxy-3-nitro-phenyl)-2-phenoxy-propanoate CAS Name: 3-(4-hydroxy-3-nitrophenyl)-2-phenoxypropanoic acid ethyl ester IUPAC Name: ethyl 3-(4-hydroxy-3-nitrophenyl)-2-phenoxypropanoate Traditional Name: 3-(4-hydroxy-3-nitro-phenyl)-2-phenoxy-propionic acid ethyl ester Formula: C17H17NO6 MolecularWeight: 331.31998

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=CC(=C(C=C1)O)[N+](=O)[O-])OC2=CC=CC=C2

Isomeric SMILES

CCOC(=O)C(CC1=CC(=C(C=C1)O)[N+](=O)[O-])OC2=CC=CC=C2

InChI

InChI=1S/C17H17NO6/c1-2-23-17(20)16(24-13-6-4-3-5-7-13)11-12-8-9-15(19)14(10-12)18(21)22/h3-10,16,19H,2,11H2,1H3