diethyl 2-[[4-(azidomethyl)-2-ethoxycarbonyl-thiophen-3-yl]methylidene]propanedioate

Systemtic Name: diethyl 2-[[4-(azidomethyl)-2-ethoxycarbonyl-thiophen-3-yl]methylidene]propanedioate Openeye Name: diethyl 2-[[4-(azidomethyl)-2-ethoxycarbonyl-3-thienyl]methylene]propanedioate CAS Name: 2-[[4-(azidomethyl)-2-ethoxycarbonyl-3-thiophenyl]methylidene]propanedioic acid diethyl ester IUPAC Name: diethyl 2-[[4-(azidomethyl)-2-ethoxycarbonylthiophen-3-yl]methylidene]propanedioate Traditional Name: 2-[[4-(azidomethyl)-2-carbethoxy-3-thienyl]methylene]malonic acid diethyl ester Formula: C16H19N3O6S MolecularWeight: 381.40356

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=CS1)CN=[N+]=[N-])C=C(C(=O)OCC)C(=O)OCC

Isomeric SMILES

CCOC(=O)C1=C(C(=CS1)CN=[N+]=[N-])C=C(C(=O)OCC)C(=O)OCC

InChI

InChI=1S/C16H19N3O6S/c1-4-23-14(20)12(15(21)24-5-2)7-11-10(8-18-19-17)9-26-13(11)16(22)25-6-3/h7,9H,4-6,8H2,1-3H3