N-[3-ethanoyl-4-[2-oxidanyl-3-(propan-2-ylamino)propoxy]phenyl]-2-iodanyl-benzamide

Systemtic Name: N-[3-ethanoyl-4-[2-oxidanyl-3-(propan-2-ylamino)propoxy]phenyl]-2-iodanyl-benzamide Openeye Name: N-[3-acetyl-4-[2-hydroxy-3-(isopropylamino)propoxy]phenyl]-2-iodo-benzamide CAS Name: N-[3-acetyl-4-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl]-2-iodobenzamide IUPAC Name: N-[3-acetyl-4-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl]-2-iodobenzamide Traditional Name: N-[3-acetyl-4-[2-hydroxy-3-(isopropylamino)propoxy]phenyl]-2-iodo-benzamide Formula: C21H25IN2O4 MolecularWeight: 496.33867

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NCC(COC1=C(C=C(C=C1)NC(=O)C2=CC=CC=C2I)C(=O)C)O

Isomeric SMILES

CC(C)NCC(COC1=C(C=C(C=C1)NC(=O)C2=CC=CC=C2I)C(=O)C)O

InChI

InChI=1S/C21H25IN2O4/c1-13(2)23-11-16(26)12-28-20-9-8-15(10-18(20)14(3)25)24-21(27)17-6-4-5-7-19(17)22/h4-10,13,16,23,26H,11-12H2,1-3H3,(H,24,27)