2,5-bis[bis(2-chloroethyl)aminomethyl]benzene-1,4-diol hydrochloride

Systemtic Name: 2,5-bis[bis(2-chloroethyl)aminomethyl]benzene-1,4-diol hydrochloride Openeye Name: 2,5-bis[bis(2-chloroethyl)aminomethyl]benzene-1,4-diol hydrochloride CAS Name: 2,5-bis[bis(2-chloroethyl)aminomethyl]benzene-1,4-diol hydrochloride IUPAC Name: 2,5-bis[bis(2-chloroethyl)aminomethyl]benzene-1,4-diol hydrochloride Traditional Name: 2,5-bis[bis(2-chloroethyl)aminomethyl]hydroquinone hydrochloride Formula: C16H25Cl5N2O2 MolecularWeight: 454.6469

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C(=CC(=C1O)CN(CCCl)CCCl)O)CN(CCCl)CCCl.Cl

Isomeric SMILES

C1=C(C(=CC(=C1O)CN(CCCl)CCCl)O)CN(CCCl)CCCl.Cl

InChI

InChI=1S/C16H24Cl4N2O2.ClH/c17-1-5-21(6-2-18)11-13-9-16(24)14(10-15(13)23)12-22(7-3-19)8-4-20;/h9-10,23-24H,1-8,11-12H2;1H