diethyl 2-[(3-azido-1-benzothiophen-2-yl)methylidene]propanedioate

Systemtic Name: diethyl 2-[(3-azido-1-benzothiophen-2-yl)methylidene]propanedioate Openeye Name: diethyl 2-[(3-azidobenzothiophen-2-yl)methylene]propanedioate CAS Name: 2-[(3-azido-1-benzothiophen-2-yl)methylidene]propanedioic acid diethyl ester IUPAC Name: diethyl 2-[(3-azido-1-benzothiophen-2-yl)methylidene]propanedioate Traditional Name: 2-[(3-azidobenzothiophen-2-yl)methylene]malonic acid diethyl ester Formula: C16H15N3O4S MolecularWeight: 345.373

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CC1=C(C2=CC=CC=C2S1)N=[N+]=[N-])C(=O)OCC

Isomeric SMILES

CCOC(=O)C(=CC1=C(C2=CC=CC=C2S1)N=[N+]=[N-])C(=O)OCC

InChI

InChI=1S/C16H15N3O4S/c1-3-22-15(20)11(16(21)23-4-2)9-13-14(18-19-17)10-7-5-6-8-12(10)24-13/h5-9H,3-4H2,1-2H3