4-[2-(5-phenylmethoxyindol-1-yl)ethanoylamino]butanoic acid

Systemtic Name: 4-[2-(5-phenylmethoxyindol-1-yl)ethanoylamino]butanoic acid Openeye Name: 4-[[2-(5-benzyloxyindol-1-yl)acetyl]amino]butanoic acid CAS Name: 4-[[1-oxo-2-(5-phenylmethoxy-1-indolyl)ethyl]amino]butanoic acid IUPAC Name: 4-[[2-(5-phenylmethoxyindol-1-yl)acetyl]amino]butanoic acid Traditional Name: 4-[[2-(5-benzoxyindol-1-yl)acetyl]amino]butyric acid Formula: C21H22N2O4 MolecularWeight: 366.41038

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CC3=C(C=C2)N(C=C3)CC(=O)NCCCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC3=C(C=C2)N(C=C3)CC(=O)NCCCC(=O)O

InChI

InChI=1S/C21H22N2O4/c24-20(22-11-4-7-21(25)26)14-23-12-10-17-13-18(8-9-19(17)23)27-15-16-5-2-1-3-6-16/h1-3,5-6,8-10,12-13H,4,7,11,14-15H2,(H,22,24)(H,25,26)