2-ethoxy-3-[4-[(4-oxidanylidene-2,3-dihydro-1,3-benzoxazin-2-yl)methoxy]phenyl]propanoic acid

Systemtic Name: 2-ethoxy-3-[4-[(4-oxidanylidene-2,3-dihydro-1,3-benzoxazin-2-yl)methoxy]phenyl]propanoic acid Openeye Name: 2-ethoxy-3-[4-[(4-oxo-2,3-dihydro-1,3-benzoxazin-2-yl)methoxy]phenyl]propanoic acid CAS Name: 2-ethoxy-3-[4-[(4-oxo-2,3-dihydro-1,3-benzoxazin-2-yl)methoxy]phenyl]propanoic acid IUPAC Name: 2-ethoxy-3-[4-[(4-oxo-2,3-dihydro-1,3-benzoxazin-2-yl)methoxy]phenyl]propanoic acid Traditional Name: 2-ethoxy-3-[4-[(4-keto-2,3-dihydro-1,3-benzoxazin-2-yl)methoxy]phenyl]propionic acid Formula: C20H21NO6 MolecularWeight: 371.38384

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(CC1=CC=C(C=C1)OCC2NC(=O)C3=CC=CC=C3O2)C(=O)O

Isomeric SMILES

CCOC(CC1=CC=C(C=C1)OCC2NC(=O)C3=CC=CC=C3O2)C(=O)O

InChI

InChI=1S/C20H21NO6/c1-2-25-17(20(23)24)11-13-7-9-14(10-8-13)26-12-18-21-19(22)15-5-3-4-6-16(15)27-18/h3-10,17-18H,2,11-12H2,1H3,(H,21,22)(H,23,24)