2-[4-[3-(3,4-dihydro-2H-1,4-benzoxazin-3-yl)propyl]phenoxy]-2-methyl-propanoic acid

Systemtic Name: 2-[4-[3-(3,4-dihydro-2H-1,4-benzoxazin-3-yl)propyl]phenoxy]-2-methyl-propanoic acid Openeye Name: 2-[4-[3-(3,4-dihydro-2H-1,4-benzoxazin-3-yl)propyl]phenoxy]-2-methyl-propanoic acid CAS Name: 2-[4-[3-(3,4-dihydro-2H-1,4-benzoxazin-3-yl)propyl]phenoxy]-2-methylpropanoic acid IUPAC Name: 2-[4-[3-(3,4-dihydro-2H-1,4-benzoxazin-3-yl)propyl]phenoxy]-2-methylpropanoic acid Traditional Name: 2-[4-[3-(3,4-dihydro-2H-1,4-benzoxazin-3-yl)propyl]phenoxy]-2-methyl-propionic acid Formula: C21H25NO4 MolecularWeight: 355.4275

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)O)OC1=CC=C(C=C1)CCCC2COC3=CC=CC=C3N2

Isomeric SMILES

CC(C)(C(=O)O)OC1=CC=C(C=C1)CCCC2COC3=CC=CC=C3N2

InChI

InChI=1S/C21H25NO4/c1-21(2,20(23)24)26-17-12-10-15(11-13-17)6-5-7-16-14-25-19-9-4-3-8-18(19)22-16/h3-4,8-13,16,22H,5-7,14H2,1-2H3,(H,23,24)