3-[4-[2-[(2-butoxyphenyl)carbonylamino]ethyl]phenyl]propanoic acid

Systemtic Name: 3-[4-[2-[(2-butoxyphenyl)carbonylamino]ethyl]phenyl]propanoic acid Openeye Name: 3-[4-[2-[(2-butoxybenzoyl)amino]ethyl]phenyl]propanoic acid CAS Name: 3-[4-[2-[[(2-butoxyphenyl)-oxomethyl]amino]ethyl]phenyl]propanoic acid IUPAC Name: 3-[4-[2-[(2-butoxybenzoyl)amino]ethyl]phenyl]propanoic acid Traditional Name: 3-[4-[2-[(2-butoxybenzoyl)amino]ethyl]phenyl]propionic acid Formula: C22H27NO4 MolecularWeight: 369.45408

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=CC=C1C(=O)NCCC2=CC=C(C=C2)CCC(=O)O

Isomeric SMILES

CCCCOC1=CC=CC=C1C(=O)NCCC2=CC=C(C=C2)CCC(=O)O

InChI

InChI=1S/C22H27NO4/c1-2-3-16-27-20-7-5-4-6-19(20)22(26)23-15-14-18-10-8-17(9-11-18)12-13-21(24)25/h4-11H,2-3,12-16H2,1H3,(H,23,26)(H,24,25)