(2R)-3-(6-iodanyl-1H-indol-3-yl)-2-(phenylmethoxycarbonylamino)propanoic acid

Systemtic Name: (2R)-3-(6-iodanyl-1H-indol-3-yl)-2-(phenylmethoxycarbonylamino)propanoic acid Openeye Name: (2R)-2-(benzyloxycarbonylamino)-3-(6-iodo-1H-indol-3-yl)propanoic acid CAS Name: (2R)-3-(6-iodo-1H-indol-3-yl)-2-(phenylmethoxycarbonylamino)propanoic acid IUPAC Name: (2R)-3-(6-iodo-1H-indol-3-yl)-2-(phenylmethoxycarbonylamino)propanoic acid Traditional Name: (2R)-2-(benzyloxycarbonylamino)-3-(6-iodo-1H-indol-3-yl)propionic acid Formula: C19H17IN2O4 MolecularWeight: 464.25375

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)NC(CC2=CNC3=C2C=CC(=C3)I)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)N[C@H](CC2=CNC3=C2C=CC(=C3)I)C(=O)O

InChI

InChI=1S/C19H17IN2O4/c20-14-6-7-15-13(10-21-16(15)9-14)8-17(18(23)24)22-19(25)26-11-12-4-2-1-3-5-12/h1-7,9-10,17,21H,8,11H2,(H,22,25)(H,23,24)/t17-/m1/s1