3-(1H-indol-3-yl)-2-(octylamino)propanoic acid

Systemtic Name: 3-(1H-indol-3-yl)-2-(octylamino)propanoic acid Openeye Name: 3-(1H-indol-3-yl)-2-(octylamino)propanoic acid CAS Name: 3-(1H-indol-3-yl)-2-(octylamino)propanoic acid IUPAC Name: 3-(1H-indol-3-yl)-2-(octylamino)propanoic acid Traditional Name: 3-(1H-indol-3-yl)-2-(octylamino)propionic acid Formula: C19H28N2O2 MolecularWeight: 316.43782

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCNC(CC1=CNC2=CC=CC=C21)C(=O)O

Isomeric SMILES

CCCCCCCCNC(CC1=CNC2=CC=CC=C21)C(=O)O

InChI

InChI=1S/C19H28N2O2/c1-2-3-4-5-6-9-12-20-18(19(22)23)13-15-14-21-17-11-8-7-10-16(15)17/h7-8,10-11,14,18,20-21H,2-6,9,12-13H2,1H3,(H,22,23)