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

Systemtic Name: 3-[3-[3-(2,3-dihydro-1,4-benzoxazin-4-yl)propylamino]phenyl]-2-ethoxy-propanoic acid Openeye Name: 3-[3-[3-(2,3-dihydro-1,4-benzoxazin-4-yl)propylamino]phenyl]-2-ethoxy-propanoic acid CAS Name: 3-[3-[3-(2,3-dihydro-1,4-benzoxazin-4-yl)propylamino]phenyl]-2-ethoxypropanoic acid IUPAC Name: 3-[3-[3-(2,3-dihydro-1,4-benzoxazin-4-yl)propylamino]phenyl]-2-ethoxypropanoic acid Traditional Name: 3-[3-[3-(2,3-dihydro-1,4-benzoxazin-4-yl)propylamino]phenyl]-2-ethoxy-propionic acid Formula: C22H28N2O4 MolecularWeight: 384.46872

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(CC1=CC(=CC=C1)NCCCN2CCOC3=CC=CC=C32)C(=O)O

Isomeric SMILES

CCOC(CC1=CC(=CC=C1)NCCCN2CCOC3=CC=CC=C32)C(=O)O

InChI

InChI=1S/C22H28N2O4/c1-2-27-21(22(25)26)16-17-7-5-8-18(15-17)23-11-6-12-24-13-14-28-20-10-4-3-9-19(20)24/h3-5,7-10,15,21,23H,2,6,11-14,16H2,1H3,(H,25,26)