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

Systemtic Name: 2-ethoxy-3-[4-[3-(2-propyl-2,3-dihydro-1,4-benzoxazin-4-yl)propylamino]phenyl]propanoic acid Openeye Name: 2-ethoxy-3-[4-[3-(2-propyl-2,3-dihydro-1,4-benzoxazin-4-yl)propylamino]phenyl]propanoic acid CAS Name: 2-ethoxy-3-[4-[3-(2-propyl-2,3-dihydro-1,4-benzoxazin-4-yl)propylamino]phenyl]propanoic acid IUPAC Name: 2-ethoxy-3-[4-[3-(2-propyl-2,3-dihydro-1,4-benzoxazin-4-yl)propylamino]phenyl]propanoic acid Traditional Name: 2-ethoxy-3-[4-[3-(2-propyl-2,3-dihydro-1,4-benzoxazin-4-yl)propylamino]phenyl]propionic acid Formula: C25H34N2O4 MolecularWeight: 426.54846

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1CN(C2=CC=CC=C2O1)CCCNC3=CC=C(C=C3)CC(C(=O)O)OCC

Isomeric SMILES

CCCC1CN(C2=CC=CC=C2O1)CCCNC3=CC=C(C=C3)CC(C(=O)O)OCC

InChI

InChI=1S/C25H34N2O4/c1-3-8-21-18-27(22-9-5-6-10-23(22)31-21)16-7-15-26-20-13-11-19(12-14-20)17-24(25(28)29)30-4-2/h5-6,9-14,21,24,26H,3-4,7-8,15-18H2,1-2H3,(H,28,29)