4-[[(6R)-6-tert-butyl-3-ethoxycarbonyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]amino]-4-oxidanylidene-but-2-enoate

Systemtic Name: 4-[[(6R)-6-tert-butyl-3-ethoxycarbonyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]amino]-4-oxidanylidene-but-2-enoate Openeye Name: 4-[[(6R)-6-tert-butyl-3-ethoxycarbonyl-4,5,6,7-tetrahydrobenzothiophen-2-yl]amino]-4-oxo-but-2-enoate CAS Name: 4-[[(6R)-6-tert-butyl-3-ethoxycarbonyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]amino]-4-oxo-2-butenoate IUPAC Name: 4-[[(6R)-6-tert-butyl-3-ethoxycarbonyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]amino]-4-oxobut-2-enoate Traditional Name: 4-[[(6R)-6-tert-butyl-3-carbethoxy-4,5,6,7-tetrahydrobenzothiophen-2-yl]amino]-4-keto-but-2-enoate Formula: C19H24NO5S- MolecularWeight: 378.46256

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC2=C1CCC(C2)C(C)(C)C)NC(=O)C=CC(=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C19H25NO5S/c1-5-25-18(24)16-12-7-6-11(19(2,3)4)10-13(12)26-17(16)20-14(21)8-9-15(22)23/h8-9,11H,5-7,10H2,1-4H3,(H,20,21)(H,22,23)/p-1/t11-/m1/s1