(2S)-2-acetamido-6-[2-(1H-indol-3-yl)ethanoylamino]hexanoic acid

Systemtic Name: (2S)-2-acetamido-6-[2-(1H-indol-3-yl)ethanoylamino]hexanoic acid Openeye Name: (2S)-2-acetamido-6-[[2-(1H-indol-3-yl)acetyl]amino]hexanoic acid CAS Name: (2S)-2-acetamido-6-[[2-(1H-indol-3-yl)-1-oxoethyl]amino]hexanoic acid IUPAC Name: (2S)-2-acetamido-6-[[2-(1H-indol-3-yl)acetyl]amino]hexanoic acid Traditional Name: (2S)-2-acetamido-6-[[2-(1H-indol-3-yl)acetyl]amino]hexanoic acid Formula: C18H23N3O4 MolecularWeight: 345.39292

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CCCCNC(=O)CC1=CNC2=CC=CC=C21)C(=O)O

Isomeric SMILES

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

InChI

InChI=1S/C18H23N3O4/c1-12(22)21-16(18(24)25)8-4-5-9-19-17(23)10-13-11-20-15-7-3-2-6-14(13)15/h2-3,6-7,11,16,20H,4-5,8-10H2,1H3,(H,19,23)(H,21,22)(H,24,25)/t16-/m0/s1