2-dimethylaminoethyl 1-methylazepane-2-carboxylate; iodanylmethane

Systemtic Name: 2-dimethylaminoethyl 1-methylazepane-2-carboxylate; iodanylmethane Openeye Name: 2-dimethylaminoethyl 1-methylazepane-2-carboxylate; iodomethane CAS Name: iodomethane; 1-methyl-2-azepanecarboxylic acid 2-dimethylaminoethyl ester IUPAC Name: 2-dimethylaminoethyl 1-methylazepane-2-carboxylate; iodomethane Traditional Name: iodomethane; 1-methylazepane-2-carboxylic acid 2-dimethylaminoethyl ester Formula: C14H30I2N2O2 MolecularWeight: 512.20914

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCCCCC1C(=O)OCCN(C)C.CI.CI

Isomeric SMILES

CN1CCCCCC1C(=O)OCCN(C)C.CI.CI

InChI

InChI=1S/C12H24N2O2.2CH3I/c1-13(2)9-10-16-12(15)11-7-5-4-6-8-14(11)3;2*1-2/h11H,4-10H2,1-3H3;2*1H3