(2S,3S)-2-(1H-indol-3-ylcarbonylamino)-3-methyl-pentanoate

Systemtic Name: (2S,3S)-2-(1H-indol-3-ylcarbonylamino)-3-methyl-pentanoate Openeye Name: (2S,3S)-2-(1H-indole-3-carbonylamino)-3-methyl-pentanoate CAS Name: (2S,3S)-2-[[1H-indol-3-yl(oxo)methyl]amino]-3-methylpentanoate IUPAC Name: (2S,3S)-2-(1H-indole-3-carbonylamino)-3-methylpentanoate Traditional Name: (2S,3S)-2-(1H-indole-3-carbonylamino)-3-methyl-valerate Formula: C15H17N2O3- MolecularWeight: 273.30708

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)[O-])NC(=O)C1=CNC2=CC=CC=C21

Isomeric SMILES

CC[C@H](C)[C@@H](C(=O)[O-])NC(=O)C1=CNC2=CC=CC=C21

InChI

InChI=1S/C15H18N2O3/c1-3-9(2)13(15(19)20)17-14(18)11-8-16-12-7-5-4-6-10(11)12/h4-9,13,16H,3H2,1-2H3,(H,17,18)(H,19,20)/p-1/t9-,13-/m0/s1