iodanylmethane; 2-piperidin-1-ylethyl 2,4-bis(oxidanyl)benzoate

Systemtic Name: iodanylmethane; 2-piperidin-1-ylethyl 2,4-bis(oxidanyl)benzoate Openeye Name: iodomethane; 2-(1-piperidyl)ethyl 2,4-dihydroxybenzoate CAS Name: 2,4-dihydroxybenzoic acid 2-(1-piperidinyl)ethyl ester; iodomethane IUPAC Name: iodomethane; 2-piperidin-1-ylethyl 2,4-dihydroxybenzoate Traditional Name: 2,4-dihydroxybenzoic acid 2-piperidinoethyl ester; iodomethane Formula: C15H22INO4 MolecularWeight: 407.24395

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Descriptors Computed from Structure

Canonical SMILES:

CI.C1CCN(CC1)CCOC(=O)C2=C(C=C(C=C2)O)O

Isomeric SMILES

CI.C1CCN(CC1)CCOC(=O)C2=C(C=C(C=C2)O)O

InChI

InChI=1S/C14H19NO4.CH3I/c16-11-4-5-12(13(17)10-11)14(18)19-9-8-15-6-2-1-3-7-15;1-2/h4-5,10,16-17H,1-3,6-9H2;1H3