3-[3-[4-(2-hydroxyethyl)piperazin-1-yl]propyl]-2-[(4-iodanyl-2-methyl-phenyl)amino]benzamide

Systemtic Name: 3-[3-[4-(2-hydroxyethyl)piperazin-1-yl]propyl]-2-[(4-iodanyl-2-methyl-phenyl)amino]benzamide Openeye Name: 3-[3-[4-(2-hydroxyethyl)piperazin-1-yl]propyl]-2-(4-iodo-2-methyl-anilino)benzamide CAS Name: 3-[3-[4-(2-hydroxyethyl)-1-piperazinyl]propyl]-2-(4-iodo-2-methylanilino)benzamide IUPAC Name: 3-[3-[4-(2-hydroxyethyl)piperazin-1-yl]propyl]-2-(4-iodo-2-methylanilino)benzamide Traditional Name: 3-[3-[4-(2-hydroxyethyl)piperazino]propyl]-2-(4-iodo-2-methyl-anilino)benzamide Formula: C23H31IN4O2 MolecularWeight: 522.42231

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)I)NC2=C(C=CC=C2CCCN3CCN(CC3)CCO)C(=O)N

Isomeric SMILES

CC1=C(C=CC(=C1)I)NC2=C(C=CC=C2CCCN3CCN(CC3)CCO)C(=O)N

InChI

InChI=1S/C23H31IN4O2/c1-17-16-19(24)7-8-21(17)26-22-18(4-2-6-20(22)23(25)30)5-3-9-27-10-12-28(13-11-27)14-15-29/h2,4,6-8,16,26,29H,3,5,9-15H2,1H3,(H2,25,30)