ethyl 5-[(E)-(2-imidazol-1-yl-1,3-diphenyl-propylidene)amino]oxy-2,2-dimethyl-pentanoate

Systemtic Name: ethyl 5-[(E)-(2-imidazol-1-yl-1,3-diphenyl-propylidene)amino]oxy-2,2-dimethyl-pentanoate Openeye Name: ethyl 5-[(E)-(2-imidazol-1-yl-1,3-diphenyl-propylidene)amino]oxy-2,2-dimethyl-pentanoate CAS Name: 5-[(E)-[2-(1-imidazolyl)-1,3-diphenylpropylidene]amino]oxy-2,2-dimethylpentanoic acid ethyl ester IUPAC Name: ethyl 5-[(E)-(2-imidazol-1-yl-1,3-diphenylpropylidene)amino]oxy-2,2-dimethylpentanoate Traditional Name: 5-[(E)-(2-imidazol-1-yl-1,3-diphenyl-propylidene)amino]oxy-2,2-dimethyl-valeric acid ethyl ester Formula: C27H33N3O3 MolecularWeight: 447.56922

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)(C)CCCON=C(C1=CC=CC=C1)C(CC2=CC=CC=C2)N3C=CN=C3

Isomeric SMILES

CCOC(=O)C(C)(C)CCCO/N=C(\C1=CC=CC=C1)/C(CC2=CC=CC=C2)N3C=CN=C3

InChI

InChI=1S/C27H33N3O3/c1-4-32-26(31)27(2,3)16-11-19-33-29-25(23-14-9-6-10-15-23)24(30-18-17-28-21-30)20-22-12-7-5-8-13-22/h5-10,12-15,17-18,21,24H,4,11,16,19-20H2,1-3H3/b29-25+