(2S)-N-[(3-hydroxyphenyl)methyl]-2-[3-(4-iodophenyl)propanoylamino]propanamide

Systemtic Name: (2S)-N-[(3-hydroxyphenyl)methyl]-2-[3-(4-iodophenyl)propanoylamino]propanamide Openeye Name: (2S)-N-[(3-hydroxyphenyl)methyl]-2-[3-(4-iodophenyl)propanoylamino]propanamide CAS Name: (2S)-N-[(3-hydroxyphenyl)methyl]-2-[[3-(4-iodophenyl)-1-oxopropyl]amino]propanamide IUPAC Name: (2S)-N-[(3-hydroxyphenyl)methyl]-2-[3-(4-iodophenyl)propanoylamino]propanamide Traditional Name: (2S)-N-(3-hydroxybenzyl)-2-[3-(4-iodophenyl)propanoylamino]propionamide Formula: C19H21IN2O3 MolecularWeight: 452.28611

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC(=CC=C1)O)NC(=O)CCC2=CC=C(C=C2)I

Isomeric SMILES

C[C@@H](C(=O)NCC1=CC(=CC=C1)O)NC(=O)CCC2=CC=C(C=C2)I

InChI

InChI=1S/C19H21IN2O3/c1-13(19(25)21-12-15-3-2-4-17(23)11-15)22-18(24)10-7-14-5-8-16(20)9-6-14/h2-6,8-9,11,13,23H,7,10,12H2,1H3,(H,21,25)(H,22,24)/t13-/m0/s1