2-ethanoyl-3-[4-(3-phenylmethoxypropylamino)phenyl]butanoic acid

Systemtic Name: 2-ethanoyl-3-[4-(3-phenylmethoxypropylamino)phenyl]butanoic acid Openeye Name: 2-acetyl-3-[4-(3-benzyloxypropylamino)phenyl]butanoic acid CAS Name: 2-acetyl-3-[4-(3-phenylmethoxypropylamino)phenyl]butanoic acid IUPAC Name: 2-acetyl-3-[4-(3-phenylmethoxypropylamino)phenyl]butanoic acid Traditional Name: 2-acetyl-3-[4-(3-benzoxypropylamino)phenyl]butyric acid Formula: C22H27NO4 MolecularWeight: 369.45408

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)NCCCOCC2=CC=CC=C2)C(C(=O)C)C(=O)O

Isomeric SMILES

CC(C1=CC=C(C=C1)NCCCOCC2=CC=CC=C2)C(C(=O)C)C(=O)O

InChI

InChI=1S/C22H27NO4/c1-16(21(17(2)24)22(25)26)19-9-11-20(12-10-19)23-13-6-14-27-15-18-7-4-3-5-8-18/h3-5,7-12,16,21,23H,6,13-15H2,1-2H3,(H,25,26)