2-[4-[2-[(5-chloranyl-2-prop-2-enoxy-phenyl)carbonylamino]ethyl]phenyl]ethanoic acid

Systemtic Name: 2-[4-[2-[(5-chloranyl-2-prop-2-enoxy-phenyl)carbonylamino]ethyl]phenyl]ethanoic acid Openeye Name: 2-[4-[2-[(2-allyloxy-5-chloro-benzoyl)amino]ethyl]phenyl]acetic acid CAS Name: 2-[4-[2-[[(5-chloro-2-prop-2-enoxyphenyl)-oxomethyl]amino]ethyl]phenyl]acetic acid IUPAC Name: 2-[4-[2-[(5-chloro-2-prop-2-enoxybenzoyl)amino]ethyl]phenyl]acetic acid Traditional Name: 2-[4-[2-[(2-allyloxy-5-chloro-benzoyl)amino]ethyl]phenyl]acetic acid Formula: C20H20ClNO4 MolecularWeight: 373.8301

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CCOC1=C(C=C(C=C1)Cl)C(=O)NCCC2=CC=C(C=C2)CC(=O)O

Isomeric SMILES

C=CCOC1=C(C=C(C=C1)Cl)C(=O)NCCC2=CC=C(C=C2)CC(=O)O

InChI

InChI=1S/C20H20ClNO4/c1-2-11-26-18-8-7-16(21)13-17(18)20(25)22-10-9-14-3-5-15(6-4-14)12-19(23)24/h2-8,13H,1,9-12H2,(H,22,25)(H,23,24)