(2S)-2-[2-(6-bromanylindol-1-yl)ethanoylamino]-3-methyl-butanoic acid

Systemtic Name: (2S)-2-[2-(6-bromanylindol-1-yl)ethanoylamino]-3-methyl-butanoic acid Openeye Name: (2S)-2-[[2-(6-bromoindol-1-yl)acetyl]amino]-3-methyl-butanoic acid CAS Name: (2S)-2-[[2-(6-bromo-1-indolyl)-1-oxoethyl]amino]-3-methylbutanoic acid IUPAC Name: (2S)-2-[[2-(6-bromoindol-1-yl)acetyl]amino]-3-methylbutanoic acid Traditional Name: (2S)-2-[[2-(6-bromoindol-1-yl)acetyl]amino]-3-methyl-butyric acid Formula: C15H17BrN2O3 MolecularWeight: 353.21108

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)O)NC(=O)CN1C=CC2=C1C=C(C=C2)Br

Isomeric SMILES

CC(C)[C@@H](C(=O)O)NC(=O)CN1C=CC2=C1C=C(C=C2)Br

InChI

InChI=1S/C15H17BrN2O3/c1-9(2)14(15(20)21)17-13(19)8-18-6-5-10-3-4-11(16)7-12(10)18/h3-7,9,14H,8H2,1-2H3,(H,17,19)(H,20,21)/t14-/m0/s1