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

Systemtic Name: 2-[2-[[(6R)-3-methoxycarbonyl-6-phenyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]amino]-2-oxidanylidene-ethoxy]ethanoate Openeye Name: 2-[2-[[(6R)-3-methoxycarbonyl-6-phenyl-4,5,6,7-tetrahydrobenzothiophen-2-yl]amino]-2-oxo-ethoxy]acetate CAS Name: 2-[2-[[(6R)-3-methoxycarbonyl-6-phenyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]amino]-2-oxoethoxy]acetate IUPAC Name: 2-[2-[[(6R)-3-methoxycarbonyl-6-phenyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]amino]-2-oxoethoxy]acetate Traditional Name: 2-[2-[[(6R)-3-carbomethoxy-6-phenyl-4,5,6,7-tetrahydrobenzothiophen-2-yl]amino]-2-keto-ethoxy]acetate Formula: C20H20NO6S- MolecularWeight: 402.4409

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(SC2=C1CCC(C2)C3=CC=CC=C3)NC(=O)COCC(=O)[O-]

Isomeric SMILES

COC(=O)C1=C(SC2=C1CC[C@H](C2)C3=CC=CC=C3)NC(=O)COCC(=O)[O-]

InChI

InChI=1S/C20H21NO6S/c1-26-20(25)18-14-8-7-13(12-5-3-2-4-6-12)9-15(14)28-19(18)21-16(22)10-27-11-17(23)24/h2-6,13H,7-11H2,1H3,(H,21,22)(H,23,24)/p-1/t13-/m1/s1