methyl (2E)-2-[(2-azidophenyl)methylidene]hex-4-ynoate

Systemtic Name: methyl (2E)-2-[(2-azidophenyl)methylidene]hex-4-ynoate Openeye Name: methyl (2E)-2-[(2-azidophenyl)methylene]hex-4-ynoate CAS Name: (2E)-2-[(2-azidophenyl)methylidene]-4-hexynoic acid methyl ester IUPAC Name: methyl (2E)-2-[(2-azidophenyl)methylidene]hex-4-ynoate Traditional Name: (2E)-2-(2-azidobenzylidene)hex-4-ynoic acid methyl ester Formula: C14H13N3O2 MolecularWeight: 255.27192

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Descriptors Computed from Structure

Canonical SMILES:

CC#CCC(=CC1=CC=CC=C1N=[N+]=[N-])C(=O)OC

Isomeric SMILES

CC#CC/C(=C\C1=CC=CC=C1N=[N+]=[N-])/C(=O)OC

InChI

InChI=1S/C14H13N3O2/c1-3-4-7-12(14(18)19-2)10-11-8-5-6-9-13(11)16-17-15/h5-6,8-10H,7H2,1-2H3/b12-10+