(2S)-3-(1H-indol-3-yl)-2-(pentylamino)propanoic acid

Systemtic Name: (2S)-3-(1H-indol-3-yl)-2-(pentylamino)propanoic acid Openeye Name: (2S)-3-(1H-indol-3-yl)-2-(pentylamino)propanoic acid CAS Name: (2S)-3-(1H-indol-3-yl)-2-(pentylamino)propanoic acid IUPAC Name: (2S)-3-(1H-indol-3-yl)-2-(pentylamino)propanoic acid Traditional Name: (2S)-2-(amylamino)-3-(1H-indol-3-yl)propionic acid Formula: C16H22N2O2 MolecularWeight: 274.35808

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCCCCN[C@@H](CC1=CNC2=CC=CC=C21)C(=O)O

InChI

InChI=1S/C16H22N2O2/c1-2-3-6-9-17-15(16(19)20)10-12-11-18-14-8-5-4-7-13(12)14/h4-5,7-8,11,15,17-18H,2-3,6,9-10H2,1H3,(H,19,20)/t15-/m0/s1