3-[2-(butoxycarbonylamino)-4-(2-methoxy-1-oxidanyl-2-oxidanylidene-ethyl)phenyl]propanoic acid

Systemtic Name: 3-[2-(butoxycarbonylamino)-4-(2-methoxy-1-oxidanyl-2-oxidanylidene-ethyl)phenyl]propanoic acid Openeye Name: 3-[2-(butoxycarbonylamino)-4-(1-hydroxy-2-methoxy-2-oxo-ethyl)phenyl]propanoic acid CAS Name: 3-[2-[[butoxy(oxo)methyl]amino]-4-(1-hydroxy-2-methoxy-2-oxoethyl)phenyl]propanoic acid IUPAC Name: 3-[2-(butoxycarbonylamino)-4-(1-hydroxy-2-methoxy-2-oxoethyl)phenyl]propanoic acid Traditional Name: 3-[2-(butoxycarbonylamino)-4-(1-hydroxy-2-keto-2-methoxy-ethyl)phenyl]propionic acid Formula: C17H23NO7 MolecularWeight: 353.36702

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)NC1=C(C=CC(=C1)C(C(=O)OC)O)CCC(=O)O

Isomeric SMILES

CCCCOC(=O)NC1=C(C=CC(=C1)C(C(=O)OC)O)CCC(=O)O

InChI

InChI=1S/C17H23NO7/c1-3-4-9-25-17(23)18-13-10-12(15(21)16(22)24-2)6-5-11(13)7-8-14(19)20/h5-6,10,15,21H,3-4,7-9H2,1-2H3,(H,18,23)(H,19,20)