methyl (2S)-2-[2-(1H-indol-3-yl)ethylamino]-3-methyl-butanoate

Systemtic Name: methyl (2S)-2-[2-(1H-indol-3-yl)ethylamino]-3-methyl-butanoate Openeye Name: methyl (2S)-2-[2-(1H-indol-3-yl)ethylamino]-3-methyl-butanoate CAS Name: (2S)-2-[2-(1H-indol-3-yl)ethylamino]-3-methylbutanoic acid methyl ester IUPAC Name: methyl (2S)-2-[2-(1H-indol-3-yl)ethylamino]-3-methylbutanoate Traditional Name: (2S)-2-[2-(1H-indol-3-yl)ethylamino]-3-methyl-butyric acid methyl ester Formula: C16H22N2O2 MolecularWeight: 274.35808

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OC)NCCC1=CNC2=CC=CC=C21

Isomeric SMILES

CC(C)[C@@H](C(=O)OC)NCCC1=CNC2=CC=CC=C21

InChI

InChI=1S/C16H22N2O2/c1-11(2)15(16(19)20-3)17-9-8-12-10-18-14-7-5-4-6-13(12)14/h4-7,10-11,15,17-18H,8-9H2,1-3H3/t15-/m0/s1