(2S)-2-(2-indol-1-ylethanoylamino)-4-methyl-pentanoic acid

Systemtic Name: (2S)-2-(2-indol-1-ylethanoylamino)-4-methyl-pentanoic acid Openeye Name: (2S)-2-[(2-indol-1-ylacetyl)amino]-4-methyl-pentanoic acid CAS Name: (2S)-2-[[2-(1-indolyl)-1-oxoethyl]amino]-4-methylpentanoic acid IUPAC Name: (2S)-2-[(2-indol-1-ylacetyl)amino]-4-methylpentanoic acid Traditional Name: (2S)-2-[(2-indol-1-ylacetyl)amino]-4-methyl-valeric acid Formula: C16H20N2O3 MolecularWeight: 288.3416

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)O)NC(=O)CN1C=CC2=CC=CC=C21

Isomeric SMILES

CC(C)C[C@@H](C(=O)O)NC(=O)CN1C=CC2=CC=CC=C21

InChI

InChI=1S/C16H20N2O3/c1-11(2)9-13(16(20)21)17-15(19)10-18-8-7-12-5-3-4-6-14(12)18/h3-8,11,13H,9-10H2,1-2H3,(H,17,19)(H,20,21)/t13-/m0/s1