2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-1-ylmethyl 2-methoxybenzoate; iodanylmethane

Systemtic Name: 2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-1-ylmethyl 2-methoxybenzoate; iodanylmethane Openeye Name: 2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-1-ylmethyl 2-methoxybenzoate; iodomethane CAS Name: iodomethane; 2-methoxybenzoic acid 2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-1-ylmethyl ester IUPAC Name: 2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-1-ylmethyl 2-methoxybenzoate; iodomethane Traditional Name: iodomethane; 2-methoxybenzoic acid quinolizidin-1-ylmethyl ester Formula: C19H28INO3 MolecularWeight: 445.33499

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C(=O)OCC2CCCN3C2CCCC3.CI

Isomeric SMILES

COC1=CC=CC=C1C(=O)OCC2CCCN3C2CCCC3.CI

InChI

InChI=1S/C18H25NO3.CH3I/c1-21-17-10-3-2-8-15(17)18(20)22-13-14-7-6-12-19-11-5-4-9-16(14)19;1-2/h2-3,8,10,14,16H,4-7,9,11-13H2,1H3;1H3