(Z)-3-[4-[2-[(5-chloranyl-2-methoxy-phenyl)carbonylamino]ethyl]phenyl]but-2-enoic acid

Systemtic Name: (Z)-3-[4-[2-[(5-chloranyl-2-methoxy-phenyl)carbonylamino]ethyl]phenyl]but-2-enoic acid Openeye Name: (Z)-3-[4-[2-[(5-chloro-2-methoxy-benzoyl)amino]ethyl]phenyl]but-2-enoic acid CAS Name: (Z)-3-[4-[2-[[(5-chloro-2-methoxyphenyl)-oxomethyl]amino]ethyl]phenyl]-2-butenoic acid IUPAC Name: (Z)-3-[4-[2-[(5-chloro-2-methoxybenzoyl)amino]ethyl]phenyl]but-2-enoic acid Traditional Name: (Z)-3-[4-[2-[(5-chloro-2-methoxy-benzoyl)amino]ethyl]phenyl]but-2-enoic acid Formula: C20H20ClNO4 MolecularWeight: 373.8301

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(=O)O)C1=CC=C(C=C1)CCNC(=O)C2=C(C=CC(=C2)Cl)OC

Isomeric SMILES

C/C(=C/C(=O)O)/C1=CC=C(C=C1)CCNC(=O)C2=C(C=CC(=C2)Cl)OC

InChI

InChI=1S/C20H20ClNO4/c1-13(11-19(23)24)15-5-3-14(4-6-15)9-10-22-20(25)17-12-16(21)7-8-18(17)26-2/h3-8,11-12H,9-10H2,1-2H3,(H,22,25)(H,23,24)/b13-11-