tert-butyl (E)-5-azanyloxy-7-imidazol-1-yl-6-phenyl-oct-5-enoate

Systemtic Name: tert-butyl (E)-5-azanyloxy-7-imidazol-1-yl-6-phenyl-oct-5-enoate Openeye Name: tert-butyl (E)-5-aminooxy-7-imidazol-1-yl-6-phenyl-oct-5-enoate CAS Name: (E)-5-aminooxy-7-(1-imidazolyl)-6-phenyl-5-octenoic acid tert-butyl ester IUPAC Name: tert-butyl (E)-5-aminooxy-7-imidazol-1-yl-6-phenyloct-5-enoate Traditional Name: (E)-5-aminooxy-7-imidazol-1-yl-6-phenyl-oct-5-enoic acid tert-butyl ester Formula: C21H29N3O3 MolecularWeight: 371.47326

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=C(CCCC(=O)OC(C)(C)C)ON)C1=CC=CC=C1)N2C=CN=C2

Isomeric SMILES

CC(/C(=C(\CCCC(=O)OC(C)(C)C)/ON)/C1=CC=CC=C1)N2C=CN=C2

InChI

InChI=1S/C21H29N3O3/c1-16(24-14-13-23-15-24)20(17-9-6-5-7-10-17)18(27-22)11-8-12-19(25)26-21(2,3)4/h5-7,9-10,13-16H,8,11-12,22H2,1-4H3/b20-18-