(2S)-2-[2-(4-chloranylindol-1-yl)ethanoylamino]-3-methyl-butanoic acid

Systemtic Name: (2S)-2-[2-(4-chloranylindol-1-yl)ethanoylamino]-3-methyl-butanoic acid Openeye Name: (2S)-2-[[2-(4-chloroindol-1-yl)acetyl]amino]-3-methyl-butanoic acid CAS Name: (2S)-2-[[2-(4-chloro-1-indolyl)-1-oxoethyl]amino]-3-methylbutanoic acid IUPAC Name: (2S)-2-[[2-(4-chloroindol-1-yl)acetyl]amino]-3-methylbutanoic acid Traditional Name: (2S)-2-[[2-(4-chloroindol-1-yl)acetyl]amino]-3-methyl-butyric acid Formula: C15H17ClN2O3 MolecularWeight: 308.76008

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)O)NC(=O)CN1C=CC2=C1C=CC=C2Cl

Isomeric SMILES

CC(C)[C@@H](C(=O)O)NC(=O)CN1C=CC2=C1C=CC=C2Cl

InChI

InChI=1S/C15H17ClN2O3/c1-9(2)14(15(20)21)17-13(19)8-18-7-6-10-11(16)4-3-5-12(10)18/h3-7,9,14H,8H2,1-2H3,(H,17,19)(H,20,21)/t14-/m0/s1