N-[2-(3,4-dimethoxyphenyl)ethyl]-3-(4-iodanyl-3-methyl-pyrazol-1-yl)propanamide

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-3-(4-iodanyl-3-methyl-pyrazol-1-yl)propanamide Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-3-(4-iodo-3-methyl-pyrazol-1-yl)propanamide CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-3-(4-iodo-3-methyl-1-pyrazolyl)propanamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-3-(4-iodo-3-methylpyrazol-1-yl)propanamide Traditional Name: N-homoveratryl-3-(4-iodo-3-methyl-pyrazol-1-yl)propionamide Formula: C17H22IN3O3 MolecularWeight: 443.27935

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C=C1I)CCC(=O)NCCC2=CC(=C(C=C2)OC)OC

Isomeric SMILES

CC1=NN(C=C1I)CCC(=O)NCCC2=CC(=C(C=C2)OC)OC

InChI

InChI=1S/C17H22IN3O3/c1-12-14(18)11-21(20-12)9-7-17(22)19-8-6-13-4-5-15(23-2)16(10-13)24-3/h4-5,10-11H,6-9H2,1-3H3,(H,19,22)