ethyl 2-(4-nitrosoimidazol-1-yl)-5-phenyl-pentanoate

Systemtic Name: ethyl 2-(4-nitrosoimidazol-1-yl)-5-phenyl-pentanoate Openeye Name: ethyl 2-(4-nitrosoimidazol-1-yl)-5-phenyl-pentanoate CAS Name: 2-(4-nitroso-1-imidazolyl)-5-phenylpentanoic acid ethyl ester IUPAC Name: ethyl 2-(4-nitrosoimidazol-1-yl)-5-phenylpentanoate Traditional Name: 2-(4-nitrosoimidazol-1-yl)-5-phenyl-valeric acid ethyl ester Formula: C16H19N3O3 MolecularWeight: 301.34036

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCCC1=CC=CC=C1)N2C=C(N=C2)N=O

Isomeric SMILES

CCOC(=O)C(CCCC1=CC=CC=C1)N2C=C(N=C2)N=O

InChI

InChI=1S/C16H19N3O3/c1-2-22-16(20)14(19-11-15(18-21)17-12-19)10-6-9-13-7-4-3-5-8-13/h3-5,7-8,11-12,14H,2,6,9-10H2,1H3