3-[3-methoxy-4-[4-(2-oxidanylidene-4H-3,1-benzoxazin-1-yl)piperidin-1-yl]carbonyl-phenoxy]propanoic acid

Systemtic Name: 3-[3-methoxy-4-[4-(2-oxidanylidene-4H-3,1-benzoxazin-1-yl)piperidin-1-yl]carbonyl-phenoxy]propanoic acid Openeye Name: 3-[3-methoxy-4-[4-(2-oxo-4H-3,1-benzoxazin-1-yl)piperidine-1-carbonyl]phenoxy]propanoic acid CAS Name: 3-[3-methoxy-4-[oxo-[4-(2-oxo-4H-3,1-benzoxazin-1-yl)-1-piperidinyl]methyl]phenoxy]propanoic acid IUPAC Name: 3-[3-methoxy-4-[4-(2-oxo-4H-3,1-benzoxazin-1-yl)piperidine-1-carbonyl]phenoxy]propanoic acid Traditional Name: 3-[4-[4-(2-keto-4H-3,1-benzoxazin-1-yl)piperidine-1-carbonyl]-3-methoxy-phenoxy]propionic acid Formula: C24H26N2O7 MolecularWeight: 454.47244

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)OCCC(=O)O)C(=O)N2CCC(CC2)N3C4=CC=CC=C4COC3=O

Isomeric SMILES

COC1=C(C=CC(=C1)OCCC(=O)O)C(=O)N2CCC(CC2)N3C4=CC=CC=C4COC3=O

InChI

InChI=1S/C24H26N2O7/c1-31-21-14-18(32-13-10-22(27)28)6-7-19(21)23(29)25-11-8-17(9-12-25)26-20-5-3-2-4-16(20)15-33-24(26)30/h2-7,14,17H,8-13,15H2,1H3,(H,27,28)