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

Systemtic Name: N-[3-ethanoyl-4-[2-oxidanyl-3-(propan-2-ylamino)propoxy]phenyl]-3-iodanyl-benzamide Openeye Name: N-[3-acetyl-4-[2-hydroxy-3-(isopropylamino)propoxy]phenyl]-3-iodo-benzamide CAS Name: N-[3-acetyl-4-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl]-3-iodobenzamide IUPAC Name: N-[3-acetyl-4-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl]-3-iodobenzamide Traditional Name: N-[3-acetyl-4-[2-hydroxy-3-(isopropylamino)propoxy]phenyl]-3-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=C2)I)C(=O)C)O

Isomeric SMILES

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

InChI

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