(2S)-N-[(3-iodanylphenyl)methyl]-3-oxidanyl-2-(3-phenylprop-2-enoylamino)propanamide

Systemtic Name: (2S)-N-[(3-iodanylphenyl)methyl]-3-oxidanyl-2-(3-phenylprop-2-enoylamino)propanamide Openeye Name: (2S)-3-hydroxy-N-[(3-iodophenyl)methyl]-2-(3-phenylprop-2-enoylamino)propanamide CAS Name: (2S)-3-hydroxy-N-[(3-iodophenyl)methyl]-2-[(1-oxo-3-phenylprop-2-enyl)amino]propanamide IUPAC Name: (2S)-3-hydroxy-N-[(3-iodophenyl)methyl]-2-(3-phenylprop-2-enoylamino)propanamide Traditional Name: (2S)-2-cinnamamido-3-hydroxy-N-(3-iodobenzyl)propionamide Formula: C19H19IN2O3 MolecularWeight: 450.27023

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C=CC(=O)NC(CO)C(=O)NCC2=CC(=CC=C2)I

Isomeric SMILES

C1=CC=C(C=C1)C=CC(=O)N[C@@H](CO)C(=O)NCC2=CC(=CC=C2)I

InChI

InChI=1S/C19H19IN2O3/c20-16-8-4-7-15(11-16)12-21-19(25)17(13-23)22-18(24)10-9-14-5-2-1-3-6-14/h1-11,17,23H,12-13H2,(H,21,25)(H,22,24)/t17-/m0/s1