(2S)-3-(1H-indol-3-yl)-2-(pentanoylamino)propanoate

Systemtic Name: (2S)-3-(1H-indol-3-yl)-2-(pentanoylamino)propanoate Openeye Name: (2S)-3-(1H-indol-3-yl)-2-(pentanoylamino)propanoate CAS Name: (2S)-3-(1H-indol-3-yl)-2-(1-oxopentylamino)propanoate IUPAC Name: (2S)-3-(1H-indol-3-yl)-2-(pentanoylamino)propanoate Traditional Name: (2S)-3-(1H-indol-3-yl)-2-(valerylamino)propionate Formula: C16H19N2O3- MolecularWeight: 287.33366

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)NC(CC1=CNC2=CC=CC=C21)C(=O)[O-]

Isomeric SMILES

CCCCC(=O)N[C@@H](CC1=CNC2=CC=CC=C21)C(=O)[O-]

InChI

InChI=1S/C16H20N2O3/c1-2-3-8-15(19)18-14(16(20)21)9-11-10-17-13-7-5-4-6-12(11)13/h4-7,10,14,17H,2-3,8-9H2,1H3,(H,18,19)(H,20,21)/p-1/t14-/m0/s1