2-[2-[[(6R)-3-cyano-6-phenyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]amino]-2-oxidanylidene-ethoxy]ethanoate

Systemtic Name: 2-[2-[[(6R)-3-cyano-6-phenyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]amino]-2-oxidanylidene-ethoxy]ethanoate Openeye Name: 2-[2-[[(6R)-3-cyano-6-phenyl-4,5,6,7-tetrahydrobenzothiophen-2-yl]amino]-2-oxo-ethoxy]acetate CAS Name: 2-[2-[[(6R)-3-cyano-6-phenyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]amino]-2-oxoethoxy]acetate IUPAC Name: 2-[2-[[(6R)-3-cyano-6-phenyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]amino]-2-oxoethoxy]acetate Traditional Name: 2-[2-[[(6R)-3-cyano-6-phenyl-4,5,6,7-tetrahydrobenzothiophen-2-yl]amino]-2-keto-ethoxy]acetate Formula: C19H17N2O4S- MolecularWeight: 369.41428

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(CC1C3=CC=CC=C3)SC(=C2C#N)NC(=O)COCC(=O)[O-]

Isomeric SMILES

C1CC2=C(C[C@@H]1C3=CC=CC=C3)SC(=C2C#N)NC(=O)COCC(=O)[O-]

InChI

InChI=1S/C19H18N2O4S/c20-9-15-14-7-6-13(12-4-2-1-3-5-12)8-16(14)26-19(15)21-17(22)10-25-11-18(23)24/h1-5,13H,6-8,10-11H2,(H,21,22)(H,23,24)/p-1/t13-/m1/s1