(2S)-2-[(1,5-dimethylindol-2-yl)carbonylamino]-3-methyl-butanoic acid

Systemtic Name: (2S)-2-[(1,5-dimethylindol-2-yl)carbonylamino]-3-methyl-butanoic acid Openeye Name: (2S)-2-[(1,5-dimethylindole-2-carbonyl)amino]-3-methyl-butanoic acid CAS Name: (2S)-2-[[(1,5-dimethyl-2-indolyl)-oxomethyl]amino]-3-methylbutanoic acid IUPAC Name: (2S)-2-[(1,5-dimethylindole-2-carbonyl)amino]-3-methylbutanoic acid Traditional Name: (2S)-2-[(1,5-dimethylindole-2-carbonyl)amino]-3-methyl-butyric acid Formula: C16H20N2O3 MolecularWeight: 288.3416

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N(C(=C2)C(=O)NC(C(C)C)C(=O)O)C

Isomeric SMILES

CC1=CC2=C(C=C1)N(C(=C2)C(=O)N[C@@H](C(C)C)C(=O)O)C

InChI

InChI=1S/C16H20N2O3/c1-9(2)14(16(20)21)17-15(19)13-8-11-7-10(3)5-6-12(11)18(13)4/h5-9,14H,1-4H3,(H,17,19)(H,20,21)/t14-/m0/s1