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(2S)-2-acetamido-3-(5-phenylmethoxy-1H-indol-3-yl)propanoate

(2S)-2-acetamido-3-(5-phenylmethoxy-1H-indol-3-yl)propanoate

Systemtic Name:(2S)-2-acetamido-3-(5-phenylmethoxy-1H-indol-3-yl)propanoate
Openeye Name:(2S)-2-acetamido-3-(5-benzyloxy-1H-indol-3-yl)propanoate
CAS Name:(2S)-2-acetamido-3-(5-phenylmethoxy-1H-indol-3-yl)propanoate
IUPAC Name:(2S)-2-acetamido-3-(5-phenylmethoxy-1H-indol-3-yl)propanoate
Traditional Name:(2S)-2-acetamido-3-(5-benzoxy-1H-indol-3-yl)propionate
Formula: C20H19N2O4-
MolecularWeight: 351.37586
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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CC1=CNC2=C1C=C(C=C2)OCC3=CC=CC=C3)C(=O)[O-]


Isomeric SMILES

CC(=O)N[C@@H](CC1=CNC2=C1C=C(C=C2)OCC3=CC=CC=C3)C(=O)[O-]


InChI

InChI=1S/C20H20N2O4/c1-13(23)22-19(20(24)25)9-15-11-21-18-8-7-16(10-17(15)18)26-12-14-5-3-2-4-6-14/h2-8,10-11,19,21H,9,12H2,1H3,(H,22,23)(H,24,25)/p-1/t19-/m0/s1


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