(2S)-2-(1H-indol-3-ylamino)-4-methyl-pentanoic acid

Systemtic Name: (2S)-2-(1H-indol-3-ylamino)-4-methyl-pentanoic acid Openeye Name: (2S)-2-(1H-indol-3-ylamino)-4-methyl-pentanoic acid CAS Name: (2S)-2-(1H-indol-3-ylamino)-4-methylpentanoic acid IUPAC Name: (2S)-2-(1H-indol-3-ylamino)-4-methylpentanoic acid Traditional Name: (2S)-2-(1H-indol-3-ylamino)-4-methyl-valeric acid Formula: C14H18N2O2 MolecularWeight: 246.30492

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)O)NC1=CNC2=CC=CC=C21

Isomeric SMILES

CC(C)C[C@@H](C(=O)O)NC1=CNC2=CC=CC=C21

InChI

InChI=1S/C14H18N2O2/c1-9(2)7-12(14(17)18)16-13-8-15-11-6-4-3-5-10(11)13/h3-6,8-9,12,15-16H,7H2,1-2H3,(H,17,18)/t12-/m0/s1