tert-butyl 3,3-dideuterio-2-[(diphenylmethylidene)amino]-3-[(1S,2R)-2-nitrocyclopropyl]propanoate

Systemtic Name: tert-butyl 3,3-dideuterio-2-[(diphenylmethylidene)amino]-3-[(1S,2R)-2-nitrocyclopropyl]propanoate Openeye Name: tert-butyl 2-(benzhydrylideneamino)-3,3-dideuterio-3-[(1S,2R)-2-nitrocyclopropyl]propanoate CAS Name: 3,3-dideuterio-2-[(diphenylmethylene)amino]-3-[(1S,2R)-2-nitrocyclopropyl]propanoic acid tert-butyl ester IUPAC Name: tert-butyl 2-(benzhydrylideneamino)-3,3-dideuterio-3-[(1S,2R)-2-nitrocyclopropyl]propanoate Traditional Name: 2-(benzhydrylideneamino)-3,3-dideuterio-3-[(1S,2R)-2-nitrocyclopropyl]propionic acid tert-butyl ester Formula: C23H26N2O4 MolecularWeight: 396.475864

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C(CC1CC1[N+](=O)[O-])N=C(C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

[2H]C([2H])([C@@H]1C[C@H]1[N+](=O)[O-])C(C(=O)OC(C)(C)C)N=C(C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C23H26N2O4/c1-23(2,3)29-22(26)19(14-18-15-20(18)25(27)28)24-21(16-10-6-4-7-11-16)17-12-8-5-9-13-17/h4-13,18-20H,14-15H2,1-3H3/t18-,19?,20-/m1/s1/i14D2