5-[bis(2-chloroethyl)aminomethyl]-2,4-dimethyl-pyridin-3-ol hydrochloride

Systemtic Name: 5-[bis(2-chloroethyl)aminomethyl]-2,4-dimethyl-pyridin-3-ol hydrochloride Openeye Name: 5-[bis(2-chloroethyl)aminomethyl]-2,4-dimethyl-pyridin-3-ol hydrochloride CAS Name: 5-[bis(2-chloroethyl)aminomethyl]-2,4-dimethyl-3-pyridinol hydrochloride IUPAC Name: 5-[bis(2-chloroethyl)aminomethyl]-2,4-dimethylpyridin-3-ol hydrochloride Traditional Name: 5-[bis(2-chloroethyl)aminomethyl]-2,4-dimethyl-pyridin-3-ol hydrochloride Formula: C12H19Cl3N2O MolecularWeight: 313.65106

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC=C1CN(CCCl)CCCl)C)O.Cl

Isomeric SMILES

CC1=C(C(=NC=C1CN(CCCl)CCCl)C)O.Cl

InChI

InChI=1S/C12H18Cl2N2O.ClH/c1-9-11(7-15-10(2)12(9)17)8-16(5-3-13)6-4-14;/h7,17H,3-6,8H2,1-2H3;1H