(2S)-3-(1H-indol-3-yl)-2-[(4-iodophenyl)methoxycarbonylamino]propanoic acid

Systemtic Name: (2S)-3-(1H-indol-3-yl)-2-[(4-iodophenyl)methoxycarbonylamino]propanoic acid Openeye Name: (2S)-3-(1H-indol-3-yl)-2-[(4-iodophenyl)methoxycarbonylamino]propanoic acid CAS Name: (2S)-3-(1H-indol-3-yl)-2-[[(4-iodophenyl)methoxy-oxomethyl]amino]propanoic acid IUPAC Name: (2S)-3-(1H-indol-3-yl)-2-[(4-iodophenyl)methoxycarbonylamino]propanoic acid Traditional Name: (2S)-3-(1H-indol-3-yl)-2-[(4-iodobenzyl)oxycarbonylamino]propionic acid Formula: C19H17IN2O4 MolecularWeight: 464.25375

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2)CC(C(=O)O)NC(=O)OCC3=CC=C(C=C3)I

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2)C[C@@H](C(=O)O)NC(=O)OCC3=CC=C(C=C3)I

InChI

InChI=1S/C19H17IN2O4/c20-14-7-5-12(6-8-14)11-26-19(25)22-17(18(23)24)9-13-10-21-16-4-2-1-3-15(13)16/h1-8,10,17,21H,9,11H2,(H,22,25)(H,23,24)/t17-/m0/s1