iodanylmethane; 3-(4-methylpiperazin-1-yl)propyl 2,2-dimethylpentanoate

Systemtic Name: iodanylmethane; 3-(4-methylpiperazin-1-yl)propyl 2,2-dimethylpentanoate Openeye Name: iodomethane; 3-(4-methylpiperazin-1-yl)propyl 2,2-dimethylpentanoate CAS Name: 2,2-dimethylpentanoic acid 3-(4-methyl-1-piperazinyl)propyl ester; iodomethane IUPAC Name: iodomethane; 3-(4-methylpiperazin-1-yl)propyl 2,2-dimethylpentanoate Traditional Name: 2,2-dimethylvaleric acid 3-(4-methylpiperazino)propyl ester; iodomethane Formula: C16H33IN2O2 MolecularWeight: 412.34989

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)(C)C(=O)OCCCN1CCN(CC1)C.CI

Isomeric SMILES

CCCC(C)(C)C(=O)OCCCN1CCN(CC1)C.CI

InChI

InChI=1S/C15H30N2O2.CH3I/c1-5-7-15(2,3)14(18)19-13-6-8-17-11-9-16(4)10-12-17;1-2/h5-13H2,1-4H3;1H3