5-iodanyl-N-[2-[4-(2-methoxyphenyl)piperazin-1-yl]-2-oxidanyl-ethyl]-1H-indole-2-carboxamide

Systemtic Name: 5-iodanyl-N-[2-[4-(2-methoxyphenyl)piperazin-1-yl]-2-oxidanyl-ethyl]-1H-indole-2-carboxamide Openeye Name: N-[2-hydroxy-2-[4-(2-methoxyphenyl)piperazin-1-yl]ethyl]-5-iodo-1H-indole-2-carboxamide CAS Name: N-[2-hydroxy-2-[4-(2-methoxyphenyl)-1-piperazinyl]ethyl]-5-iodo-1H-indole-2-carboxamide IUPAC Name: N-[2-hydroxy-2-[4-(2-methoxyphenyl)piperazin-1-yl]ethyl]-5-iodo-1H-indole-2-carboxamide Traditional Name: N-[2-hydroxy-2-[4-(2-methoxyphenyl)piperazino]ethyl]-5-iodo-1H-indole-2-carboxamide Formula: C22H25IN4O3 MolecularWeight: 520.36337

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CCN(CC2)C(CNC(=O)C3=CC4=C(N3)C=CC(=C4)I)O

Isomeric SMILES

COC1=CC=CC=C1N2CCN(CC2)C(CNC(=O)C3=CC4=C(N3)C=CC(=C4)I)O

InChI

InChI=1S/C22H25IN4O3/c1-30-20-5-3-2-4-19(20)26-8-10-27(11-9-26)21(28)14-24-22(29)18-13-15-12-16(23)6-7-17(15)25-18/h2-7,12-13,21,25,28H,8-11,14H2,1H3,(H,24,29)