2-[(5-methoxy-1-benzothiophen-2-yl)-prop-2-enoxycarbonyl-amino]ethanoic acid

Systemtic Name: 2-[(5-methoxy-1-benzothiophen-2-yl)-prop-2-enoxycarbonyl-amino]ethanoic acid Openeye Name: 2-[allyloxycarbonyl-(5-methoxybenzothiophen-2-yl)amino]acetic acid CAS Name: 2-[(5-methoxy-1-benzothiophen-2-yl)-[oxo(prop-2-enoxy)methyl]amino]acetic acid IUPAC Name: 2-[(5-methoxy-1-benzothiophen-2-yl)-prop-2-enoxycarbonylamino]acetic acid Traditional Name: 2-[allyloxycarbonyl-(5-methoxybenzothiophen-2-yl)amino]acetic acid Formula: C15H15NO5S MolecularWeight: 321.3483

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)SC(=C2)N(CC(=O)O)C(=O)OCC=C

Isomeric SMILES

COC1=CC2=C(C=C1)SC(=C2)N(CC(=O)O)C(=O)OCC=C

InChI

InChI=1S/C15H15NO5S/c1-3-6-21-15(19)16(9-14(17)18)13-8-10-7-11(20-2)4-5-12(10)22-13/h3-5,7-8H,1,6,9H2,2H3,(H,17,18)