N-[(2S)-1-ethylpyrrolidin-2-yl]-3-iodanyl-6-methoxy-N-methyl-2-oxidanyl-benzamide

Systemtic Name: N-[(2S)-1-ethylpyrrolidin-2-yl]-3-iodanyl-6-methoxy-N-methyl-2-oxidanyl-benzamide Openeye Name: N-[(2S)-1-ethylpyrrolidin-2-yl]-2-hydroxy-3-iodanyl-6-methoxy-N-methyl-benzamide CAS Name: N-[(2S)-1-ethyl-2-pyrrolidinyl]-2-hydroxy-3-iodanyl-6-methoxy-N-methylbenzamide IUPAC Name: N-[(2S)-1-ethylpyrrolidin-2-yl]-2-hydroxy-3-iodanyl-6-methoxy-N-methylbenzamide Traditional Name: N-[(2S)-1-ethylpyrrolidin-2-yl]-2-hydroxy-3-iodanyl-6-methoxy-N-methyl-benzamide Formula: C15H21IN2O3 MolecularWeight: 400.244438

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCCC1N(C)C(=O)C2=C(C=CC(=C2O)I)OC

Isomeric SMILES

CCN1CCC[C@@H]1N(C)C(=O)C2=C(C=CC(=C2O)[123I])OC

InChI

InChI=1S/C15H21IN2O3/c1-4-18-9-5-6-12(18)17(2)15(20)13-11(21-3)8-7-10(16)14(13)19/h7-8,12,19H,4-6,9H2,1-3H3/t12-/m1/s1/i16-4