2-[3-(azidomethyl)-4-oxidanyl-phenyl]-2-[[(E)-4-ethoxy-4-oxidanylidene-but-2-en-2-yl]amino]ethanoic acid

Systemtic Name: 2-[3-(azidomethyl)-4-oxidanyl-phenyl]-2-[[(E)-4-ethoxy-4-oxidanylidene-but-2-en-2-yl]amino]ethanoic acid Openeye Name: 2-[3-(azidomethyl)-4-hydroxy-phenyl]-2-[[(E)-3-ethoxy-1-methyl-3-oxo-prop-1-enyl]amino]acetic acid CAS Name: 2-[3-(azidomethyl)-4-hydroxyphenyl]-2-[[(E)-4-ethoxy-4-oxobut-2-en-2-yl]amino]acetic acid IUPAC Name: 2-[3-(azidomethyl)-4-hydroxyphenyl]-2-[[(E)-4-ethoxy-4-oxobut-2-en-2-yl]amino]acetic acid Traditional Name: 2-[3-(azidomethyl)-4-hydroxy-phenyl]-2-[[(E)-3-ethoxy-3-keto-1-methyl-prop-1-enyl]amino]acetic acid Formula: C15H18N4O5 MolecularWeight: 334.32722

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=C(C)NC(C1=CC(=C(C=C1)O)CN=[N+]=[N-])C(=O)O

Isomeric SMILES

CCOC(=O)/C=C(\C)/NC(C1=CC(=C(C=C1)O)CN=[N+]=[N-])C(=O)O

InChI

InChI=1S/C15H18N4O5/c1-3-24-13(21)6-9(2)18-14(15(22)23)10-4-5-12(20)11(7-10)8-17-19-16/h4-7,14,18,20H,3,8H2,1-2H3,(H,22,23)/b9-6+