N-[4-[(3,4-diethoxyphenyl)methoxy]phenyl]-3-(4-iodanyl-3-methyl-pyrazol-1-yl)propanamide

Systemtic Name: N-[4-[(3,4-diethoxyphenyl)methoxy]phenyl]-3-(4-iodanyl-3-methyl-pyrazol-1-yl)propanamide Openeye Name: N-[4-[(3,4-diethoxyphenyl)methoxy]phenyl]-3-(4-iodo-3-methyl-pyrazol-1-yl)propanamide CAS Name: N-[4-[(3,4-diethoxyphenyl)methoxy]phenyl]-3-(4-iodo-3-methyl-1-pyrazolyl)propanamide IUPAC Name: N-[4-[(3,4-diethoxyphenyl)methoxy]phenyl]-3-(4-iodo-3-methylpyrazol-1-yl)propanamide Traditional Name: N-[4-(3,4-diethoxybenzyl)oxyphenyl]-3-(4-iodo-3-methyl-pyrazol-1-yl)propionamide Formula: C24H28IN3O4 MolecularWeight: 549.40129

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)COC2=CC=C(C=C2)NC(=O)CCN3C=C(C(=N3)C)I)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)COC2=CC=C(C=C2)NC(=O)CCN3C=C(C(=N3)C)I)OCC

InChI

InChI=1S/C24H28IN3O4/c1-4-30-22-11-6-18(14-23(22)31-5-2)16-32-20-9-7-19(8-10-20)26-24(29)12-13-28-15-21(25)17(3)27-28/h6-11,14-15H,4-5,12-13,16H2,1-3H3,(H,26,29)