azane; (E)-4-iodanyl-N-[4-(4-methyl-2-oxidanyl-pentoxy)phenyl]but-3-enamide

Systemtic Name: azane; (E)-4-iodanyl-N-[4-(4-methyl-2-oxidanyl-pentoxy)phenyl]but-3-enamide Openeye Name: ammonia; (E)-N-[4-(2-hydroxy-4-methyl-pentoxy)phenyl]-4-iodo-but-3-enamide CAS Name: ammonia; (E)-N-[4-(2-hydroxy-4-methylpentoxy)phenyl]-4-iodo-3-butenamide IUPAC Name: azane; (E)-N-[4-(2-hydroxy-4-methylpentoxy)phenyl]-4-iodobut-3-enamide Traditional Name: ammonia; (E)-N-[4-(2-hydroxy-4-methyl-pentoxy)phenyl]-4-iodo-but-3-enamide Formula: C16H25IN2O3 MolecularWeight: 420.28577

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(COC1=CC=C(C=C1)NC(=O)CC=CI)O.N

Isomeric SMILES

CC(C)CC(COC1=CC=C(C=C1)NC(=O)C/C=C/I)O.N

InChI

InChI=1S/C16H22INO3.H3N/c1-12(2)10-14(19)11-21-15-7-5-13(6-8-15)18-16(20)4-3-9-17;/h3,5-9,12,14,19H,4,10-11H2,1-2H3,(H,18,20);1H3/b9-3+;