methyl (2E)-2-[(2-azido-5-methoxy-phenyl)methylidene]pent-4-ynoate

Systemtic Name: methyl (2E)-2-[(2-azido-5-methoxy-phenyl)methylidene]pent-4-ynoate Openeye Name: methyl (2E)-2-[(2-azido-5-methoxy-phenyl)methylene]pent-4-ynoate CAS Name: (2E)-2-[(2-azido-5-methoxyphenyl)methylidene]-4-pentynoic acid methyl ester IUPAC Name: methyl (2E)-2-[(2-azido-5-methoxyphenyl)methylidene]pent-4-ynoate Traditional Name: (2E)-2-(2-azido-5-methoxy-benzylidene)pent-4-ynoic acid methyl ester Formula: C14H13N3O3 MolecularWeight: 271.27132

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)N=[N+]=[N-])C=C(CC#C)C(=O)OC

Isomeric SMILES

COC1=CC(=C(C=C1)N=[N+]=[N-])/C=C(\CC#C)/C(=O)OC

InChI

InChI=1S/C14H13N3O3/c1-4-5-10(14(18)20-3)8-11-9-12(19-2)6-7-13(11)16-17-15/h1,6-9H,5H2,2-3H3/b10-8+