3-[[3-(4-phenylbutoxy)phenyl]methylamino]propanoic acid

Systemtic Name: 3-[[3-(4-phenylbutoxy)phenyl]methylamino]propanoic acid Openeye Name: 3-[[3-(4-phenylbutoxy)phenyl]methylamino]propanoic acid CAS Name: 3-[[3-(4-phenylbutoxy)phenyl]methylamino]propanoic acid IUPAC Name: 3-[[3-(4-phenylbutoxy)phenyl]methylamino]propanoic acid Traditional Name: 3-[[3-(4-phenylbutoxy)benzyl]amino]propionic acid Formula: C20H25NO3 MolecularWeight: 327.4174

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCCOC2=CC=CC(=C2)CNCCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CCCCOC2=CC=CC(=C2)CNCCC(=O)O

InChI

InChI=1S/C20H25NO3/c22-20(23)12-13-21-16-18-10-6-11-19(15-18)24-14-5-4-9-17-7-2-1-3-8-17/h1-3,6-8,10-11,15,21H,4-5,9,12-14,16H2,(H,22,23)