diethyl 2-[(2,3-dihydro-1-benzothiophen-6-ylamino)methylidene]propanedioate

Systemtic Name: diethyl 2-[(2,3-dihydro-1-benzothiophen-6-ylamino)methylidene]propanedioate Openeye Name: diethyl 2-[(2,3-dihydrobenzothiophen-6-ylamino)methylene]propanedioate CAS Name: 2-[(2,3-dihydro-1-benzothiophen-6-ylamino)methylidene]propanedioic acid diethyl ester IUPAC Name: diethyl 2-[(2,3-dihydro-1-benzothiophen-6-ylamino)methylidene]propanedioate Traditional Name: 2-[(2,3-dihydrobenzothiophen-6-ylamino)methylene]malonic acid diethyl ester Formula: C16H19NO4S MolecularWeight: 321.39136

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CNC1=CC2=C(CCS2)C=C1)C(=O)OCC

Isomeric SMILES

CCOC(=O)C(=CNC1=CC2=C(CCS2)C=C1)C(=O)OCC

InChI

InChI=1S/C16H19NO4S/c1-3-20-15(18)13(16(19)21-4-2)10-17-12-6-5-11-7-8-22-14(11)9-12/h5-6,9-10,17H,3-4,7-8H2,1-2H3