[(E)-4-methoxy-4-oxidanylidene-but-2-enyl] (2R,3R)-3-phenyl-1-(phenylmethyl)aziridine-2-carboxylate

Systemtic Name: [(E)-4-methoxy-4-oxidanylidene-but-2-enyl] (2R,3R)-3-phenyl-1-(phenylmethyl)aziridine-2-carboxylate Openeye Name: [(E)-4-methoxy-4-oxo-but-2-enyl] (2R,3R)-1-benzyl-3-phenyl-aziridine-2-carboxylate CAS Name: (2R,3R)-3-phenyl-1-(phenylmethyl)-2-aziridinecarboxylic acid [(E)-4-methoxy-4-oxobut-2-enyl] ester IUPAC Name: [(E)-4-methoxy-4-oxobut-2-enyl] (2R,3R)-1-benzyl-3-phenylaziridine-2-carboxylate Traditional Name: (2R,3R)-1-benzyl-3-phenyl-ethylenimine-2-carboxylic acid [(E)-4-keto-4-methoxy-but-2-enyl] ester Formula: C21H21NO4 MolecularWeight: 351.39574

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C=CCOC(=O)C1C(N1CC2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

COC(=O)/C=C/COC(=O)[C@H]1[C@H](N1CC2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C21H21NO4/c1-25-18(23)13-8-14-26-21(24)20-19(17-11-6-3-7-12-17)22(20)15-16-9-4-2-5-10-16/h2-13,19-20H,14-15H2,1H3/b13-8+/t19-,20-,22?/m1/s1