5-azanyl-2-[1-(4-iodophenyl)ethyl]-1H-pyrazol-3-one

Systemtic Name: 5-azanyl-2-[1-(4-iodophenyl)ethyl]-1H-pyrazol-3-one Openeye Name: 5-amino-2-[1-(4-iodophenyl)ethyl]-1H-pyrazol-3-one CAS Name: 5-amino-2-[1-(4-iodophenyl)ethyl]-1H-pyrazol-3-one IUPAC Name: 5-amino-2-[1-(4-iodophenyl)ethyl]-1H-pyrazol-3-one Traditional Name: 5-amino-2-[1-(4-iodophenyl)ethyl]-3-pyrazolin-3-one Formula: C11H12IN3O MolecularWeight: 329.13695

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)I)N2C(=O)C=C(N2)N

Isomeric SMILES

CC(C1=CC=C(C=C1)I)N2C(=O)C=C(N2)N

InChI

InChI=1S/C11H12IN3O/c1-7(8-2-4-9(12)5-3-8)15-11(16)6-10(13)14-15/h2-7,14H,13H2,1H3