tert-butyl (2S,3S)-2-[(Z)-3-methoxy-3-oxidanylidene-prop-1-enyl]-3-(phenylmethoxymethyl)aziridine-1-carboxylate

Systemtic Name: tert-butyl (2S,3S)-2-[(Z)-3-methoxy-3-oxidanylidene-prop-1-enyl]-3-(phenylmethoxymethyl)aziridine-1-carboxylate Openeye Name: tert-butyl (2S,3S)-2-(benzyloxymethyl)-3-[(Z)-3-methoxy-3-oxo-prop-1-enyl]aziridine-1-carboxylate CAS Name: (2S,3S)-2-[(Z)-3-methoxy-3-oxoprop-1-enyl]-3-(phenylmethoxymethyl)-1-aziridinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (2S,3S)-2-[(Z)-3-methoxy-3-oxoprop-1-enyl]-3-(phenylmethoxymethyl)aziridine-1-carboxylate Traditional Name: (2S,3S)-2-(benzoxymethyl)-3-[(Z)-3-keto-3-methoxy-prop-1-enyl]ethylenimine-1-carboxylic acid tert-butyl ester Formula: C19H25NO5 MolecularWeight: 347.4055

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C(C1C=CC(=O)OC)COCC2=CC=CC=C2

Isomeric SMILES

CC(C)(C)OC(=O)N1[C@@H]([C@@H]1/C=C\C(=O)OC)COCC2=CC=CC=C2

InChI

InChI=1S/C19H25NO5/c1-19(2,3)25-18(22)20-15(10-11-17(21)23-4)16(20)13-24-12-14-8-6-5-7-9-14/h5-11,15-16H,12-13H2,1-4H3/b11-10-/t15-,16+,20?/m0/s1