ethyl 4-azido-2-phenyl-2-[(E)-(2-phenylaziridin-1-yl)iminomethyl]butanoate

Systemtic Name: ethyl 4-azido-2-phenyl-2-[(E)-(2-phenylaziridin-1-yl)iminomethyl]butanoate Openeye Name: ethyl 4-azido-2-phenyl-2-[(E)-(2-phenylaziridin-1-yl)iminomethyl]butanoate CAS Name: 4-azido-2-phenyl-2-[(E)-(2-phenyl-1-aziridinyl)iminomethyl]butanoic acid ethyl ester IUPAC Name: ethyl 4-azido-2-phenyl-2-[(E)-(2-phenylaziridin-1-yl)iminomethyl]butanoate Traditional Name: 4-azido-2-phenyl-2-[(E)-(2-phenylethylenimin-1-yl)iminomethyl]butyric acid ethyl ester Formula: C21H23N5O2 MolecularWeight: 377.43962

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCN=[N+]=[N-])(C=NN1CC1C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C(CCN=[N+]=[N-])(/C=N/N1CC1C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C21H23N5O2/c1-2-28-20(27)21(13-14-23-25-22,18-11-7-4-8-12-18)16-24-26-15-19(26)17-9-5-3-6-10-17/h3-12,16,19H,2,13-15H2,1H3/b24-16+