4-[4-[[ethanoyl(3-phenylpropyl)amino]methyl]phenoxy]butanoic acid

Systemtic Name: 4-[4-[[ethanoyl(3-phenylpropyl)amino]methyl]phenoxy]butanoic acid Openeye Name: 4-[4-[[acetyl(3-phenylpropyl)amino]methyl]phenoxy]butanoic acid CAS Name: 4-[4-[[acetyl(3-phenylpropyl)amino]methyl]phenoxy]butanoic acid IUPAC Name: 4-[4-[[acetyl(3-phenylpropyl)amino]methyl]phenoxy]butanoic acid Traditional Name: 4-[4-[[acetyl(3-phenylpropyl)amino]methyl]phenoxy]butyric acid Formula: C22H27NO4 MolecularWeight: 369.45408

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N(CCCC1=CC=CC=C1)CC2=CC=C(C=C2)OCCCC(=O)O

Isomeric SMILES

CC(=O)N(CCCC1=CC=CC=C1)CC2=CC=C(C=C2)OCCCC(=O)O

InChI

InChI=1S/C22H27NO4/c1-18(24)23(15-5-9-19-7-3-2-4-8-19)17-20-11-13-21(14-12-20)27-16-6-10-22(25)26/h2-4,7-8,11-14H,5-6,9-10,15-17H2,1H3,(H,25,26)