1-[bis(2-chloroethyl)amino]-4-methyl-oct-2-yn-4-ol hydrochloride

Systemtic Name: 1-[bis(2-chloroethyl)amino]-4-methyl-oct-2-yn-4-ol hydrochloride Openeye Name: 1-[bis(2-chloroethyl)amino]-4-methyl-oct-2-yn-4-ol hydrochloride CAS Name: 1-[bis(2-chloroethyl)amino]-4-methyl-2-octyn-4-ol hydrochloride IUPAC Name: 1-[bis(2-chloroethyl)amino]-4-methyloct-2-yn-4-ol hydrochloride Traditional Name: 1-[bis(2-chloroethyl)amino]-4-methyl-oct-2-yn-4-ol hydrochloride Formula: C13H24Cl3NO MolecularWeight: 316.69476

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C)(C#CCN(CCCl)CCCl)O.Cl

Isomeric SMILES

CCCCC(C)(C#CCN(CCCl)CCCl)O.Cl

InChI

InChI=1S/C13H23Cl2NO.ClH/c1-3-4-6-13(2,17)7-5-10-16(11-8-14)12-9-15;/h17H,3-4,6,8-12H2,1-2H3;1H