(phenylmethyl) (2S,3R)-2-azanyl-3-(1H-indol-3-yl)-3-phenyl-propanoate

Systemtic Name: (phenylmethyl) (2S,3R)-2-azanyl-3-(1H-indol-3-yl)-3-phenyl-propanoate Openeye Name: benzyl (2S,3R)-2-amino-3-(1H-indol-3-yl)-3-phenyl-propanoate CAS Name: (2S,3R)-2-amino-3-(1H-indol-3-yl)-3-phenylpropanoic acid (phenylmethyl) ester IUPAC Name: benzyl (2S,3R)-2-amino-3-(1H-indol-3-yl)-3-phenylpropanoate Traditional Name: (2S,3R)-2-amino-3-(1H-indol-3-yl)-3-phenyl-propionic acid benzyl ester Formula: C24H22N2O2 MolecularWeight: 370.44368

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)C(C(C2=CC=CC=C2)C3=CNC4=CC=CC=C43)N

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)[C@H]([C@H](C2=CC=CC=C2)C3=CNC4=CC=CC=C43)N

InChI

InChI=1S/C24H22N2O2/c25-23(24(27)28-16-17-9-3-1-4-10-17)22(18-11-5-2-6-12-18)20-15-26-21-14-8-7-13-19(20)21/h1-15,22-23,26H,16,25H2/t22-,23+/m1/s1