(phenylmethyl) (2S)-2-[1H-indol-4-yl(methyl)amino]-3-methyl-butanoate

Systemtic Name: (phenylmethyl) (2S)-2-[1H-indol-4-yl(methyl)amino]-3-methyl-butanoate Openeye Name: benzyl (2S)-2-[1H-indol-4-yl(methyl)amino]-3-methyl-butanoate CAS Name: (2S)-2-[1H-indol-4-yl(methyl)amino]-3-methylbutanoic acid (phenylmethyl) ester IUPAC Name: benzyl (2S)-2-[1H-indol-4-yl(methyl)amino]-3-methylbutanoate Traditional Name: (2S)-2-[1H-indol-4-yl(methyl)amino]-3-methyl-butyric acid benzyl ester Formula: C21H24N2O2 MolecularWeight: 336.42746

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OCC1=CC=CC=C1)N(C)C2=CC=CC3=C2C=CN3

Isomeric SMILES

CC(C)[C@@H](C(=O)OCC1=CC=CC=C1)N(C)C2=CC=CC3=C2C=CN3

InChI

InChI=1S/C21H24N2O2/c1-15(2)20(21(24)25-14-16-8-5-4-6-9-16)23(3)19-11-7-10-18-17(19)12-13-22-18/h4-13,15,20,22H,14H2,1-3H3/t20-/m0/s1