iodanylmethane; 2-piperidin-1-ylethyl 3-methyl-1-benzofuran-2-carboxylate

Systemtic Name: iodanylmethane; 2-piperidin-1-ylethyl 3-methyl-1-benzofuran-2-carboxylate Openeye Name: iodomethane; 2-(1-piperidyl)ethyl 3-methylbenzofuran-2-carboxylate CAS Name: iodomethane; 3-methyl-2-benzofurancarboxylic acid 2-(1-piperidinyl)ethyl ester IUPAC Name: iodomethane; 2-piperidin-1-ylethyl 3-methyl-1-benzofuran-2-carboxylate Traditional Name: iodomethane; 3-methylcoumarilic acid 2-piperidinoethyl ester Formula: C18H24INO3 MolecularWeight: 429.29253

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=CC=CC=C12)C(=O)OCCN3CCCCC3.CI

Isomeric SMILES

CC1=C(OC2=CC=CC=C12)C(=O)OCCN3CCCCC3.CI

InChI

InChI=1S/C17H21NO3.CH3I/c1-13-14-7-3-4-8-15(14)21-16(13)17(19)20-12-11-18-9-5-2-6-10-18;1-2/h3-4,7-8H,2,5-6,9-12H2,1H3;1H3