2-ethoxy-3-[4-[3-(7-methyl-4-oxidanylidene-2H-1,3-benzoxazin-3-yl)propyl]phenyl]propanoic acid

Systemtic Name: 2-ethoxy-3-[4-[3-(7-methyl-4-oxidanylidene-2H-1,3-benzoxazin-3-yl)propyl]phenyl]propanoic acid Openeye Name: 2-ethoxy-3-[4-[3-(7-methyl-4-oxo-2H-1,3-benzoxazin-3-yl)propyl]phenyl]propanoic acid CAS Name: 2-ethoxy-3-[4-[3-(7-methyl-4-oxo-2H-1,3-benzoxazin-3-yl)propyl]phenyl]propanoic acid IUPAC Name: 2-ethoxy-3-[4-[3-(7-methyl-4-oxo-2H-1,3-benzoxazin-3-yl)propyl]phenyl]propanoic acid Traditional Name: 2-ethoxy-3-[4-[3-(4-keto-7-methyl-2H-1,3-benzoxazin-3-yl)propyl]phenyl]propionic acid Formula: C23H27NO5 MolecularWeight: 397.46418

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(CC1=CC=C(C=C1)CCCN2COC3=C(C2=O)C=CC(=C3)C)C(=O)O

Isomeric SMILES

CCOC(CC1=CC=C(C=C1)CCCN2COC3=C(C2=O)C=CC(=C3)C)C(=O)O

InChI

InChI=1S/C23H27NO5/c1-3-28-21(23(26)27)14-18-9-7-17(8-10-18)5-4-12-24-15-29-20-13-16(2)6-11-19(20)22(24)25/h6-11,13,21H,3-5,12,14-15H2,1-2H3,(H,26,27)