3-[4-[2-[2-(4-bromophenyl)ethylamino]-2-oxidanylidene-ethoxy]phenyl]-2-methoxy-propanoic acid

Systemtic Name: 3-[4-[2-[2-(4-bromophenyl)ethylamino]-2-oxidanylidene-ethoxy]phenyl]-2-methoxy-propanoic acid Openeye Name: 3-[4-[2-[2-(4-bromophenyl)ethylamino]-2-oxo-ethoxy]phenyl]-2-methoxy-propanoic acid CAS Name: 3-[4-[2-[2-(4-bromophenyl)ethylamino]-2-oxoethoxy]phenyl]-2-methoxypropanoic acid IUPAC Name: 3-[4-[2-[2-(4-bromophenyl)ethylamino]-2-oxoethoxy]phenyl]-2-methoxypropanoic acid Traditional Name: 3-[4-[2-[2-(4-bromophenyl)ethylamino]-2-keto-ethoxy]phenyl]-2-methoxy-propionic acid Formula: C20H22BrNO5 MolecularWeight: 436.29638

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Descriptors Computed from Structure

Canonical SMILES:

COC(CC1=CC=C(C=C1)OCC(=O)NCCC2=CC=C(C=C2)Br)C(=O)O

Isomeric SMILES

COC(CC1=CC=C(C=C1)OCC(=O)NCCC2=CC=C(C=C2)Br)C(=O)O

InChI

InChI=1S/C20H22BrNO5/c1-26-18(20(24)25)12-15-4-8-17(9-5-15)27-13-19(23)22-11-10-14-2-6-16(21)7-3-14/h2-9,18H,10-13H2,1H3,(H,22,23)(H,24,25)