(2S)-2-[2-(3-ethanoylindol-1-yl)ethanoylamino]-3-methyl-butanoic acid

Systemtic Name: (2S)-2-[2-(3-ethanoylindol-1-yl)ethanoylamino]-3-methyl-butanoic acid Openeye Name: (2S)-2-[[2-(3-acetylindol-1-yl)acetyl]amino]-3-methyl-butanoic acid CAS Name: (2S)-2-[[2-(3-acetyl-1-indolyl)-1-oxoethyl]amino]-3-methylbutanoic acid IUPAC Name: (2S)-2-[[2-(3-acetylindol-1-yl)acetyl]amino]-3-methylbutanoic acid Traditional Name: (2S)-2-[[2-(3-acetylindol-1-yl)acetyl]amino]-3-methyl-butyric acid Formula: C17H20N2O4 MolecularWeight: 316.3517

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)O)NC(=O)CN1C=C(C2=CC=CC=C21)C(=O)C

Isomeric SMILES

CC(C)[C@@H](C(=O)O)NC(=O)CN1C=C(C2=CC=CC=C21)C(=O)C

InChI

InChI=1S/C17H20N2O4/c1-10(2)16(17(22)23)18-15(21)9-19-8-13(11(3)20)12-6-4-5-7-14(12)19/h4-8,10,16H,9H2,1-3H3,(H,18,21)(H,22,23)/t16-/m0/s1