2-azanyl-3-[2-(4-phenylbutyl)-1H-indol-3-yl]propanoic acid

Systemtic Name: 2-azanyl-3-[2-(4-phenylbutyl)-1H-indol-3-yl]propanoic acid Openeye Name: 2-amino-3-[2-(4-phenylbutyl)-1H-indol-3-yl]propanoic acid CAS Name: 2-amino-3-[2-(4-phenylbutyl)-1H-indol-3-yl]propanoic acid IUPAC Name: 2-amino-3-[2-(4-phenylbutyl)-1H-indol-3-yl]propanoic acid Traditional Name: 2-amino-3-[2-(4-phenylbutyl)-1H-indol-3-yl]propionic acid Formula: C21H24N2O2 MolecularWeight: 336.42746

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCCC2=C(C3=CC=CC=C3N2)CC(C(=O)O)N

Isomeric SMILES

C1=CC=C(C=C1)CCCCC2=C(C3=CC=CC=C3N2)CC(C(=O)O)N

InChI

InChI=1S/C21H24N2O2/c22-18(21(24)25)14-17-16-11-5-7-12-19(16)23-20(17)13-6-4-10-15-8-2-1-3-9-15/h1-3,5,7-9,11-12,18,23H,4,6,10,13-14,22H2,(H,24,25)