bis(2-chloroethyl)-(3-methyl-4-oxidanyl-phenyl)azanium

Systemtic Name: bis(2-chloroethyl)-(3-methyl-4-oxidanyl-phenyl)azanium Openeye Name: bis(2-chloroethyl)-(4-hydroxy-3-methyl-phenyl)ammonium CAS Name: bis(2-chloroethyl)-(4-hydroxy-3-methylphenyl)ammonium IUPAC Name: bis(2-chloroethyl)-(4-hydroxy-3-methylphenyl)azanium Traditional Name: bis(2-chloroethyl)-(4-hydroxy-3-methyl-phenyl)ammonium Formula: C11H16Cl2NO+ MolecularWeight: 249.15684

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)[NH+](CCCl)CCCl)O

Isomeric SMILES

CC1=C(C=CC(=C1)[NH+](CCCl)CCCl)O

InChI

InChI=1S/C11H15Cl2NO/c1-9-8-10(2-3-11(9)15)14(6-4-12)7-5-13/h2-3,8,15H,4-7H2,1H3/p+1