N,N-bis(2-chloroethyl)-3-(4-methylphenyl)butan-1-amine hydrochloride

Systemtic Name: N,N-bis(2-chloroethyl)-3-(4-methylphenyl)butan-1-amine hydrochloride Openeye Name: N,N-bis(2-chloroethyl)-3-(p-tolyl)butan-1-amine hydrochloride CAS Name: N,N-bis(2-chloroethyl)-3-(4-methylphenyl)-1-butanamine hydrochloride IUPAC Name: N,N-bis(2-chloroethyl)-3-(4-methylphenyl)butan-1-amine hydrochloride Traditional Name: bis(2-chloroethyl)-[3-(p-tolyl)butyl]amine hydrochloride Formula: C15H24Cl3N MolecularWeight: 324.71676

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C)CCN(CCCl)CCCl.Cl

Isomeric SMILES

CC1=CC=C(C=C1)C(C)CCN(CCCl)CCCl.Cl

InChI

InChI=1S/C15H23Cl2N.ClH/c1-13-3-5-15(6-4-13)14(2)7-10-18(11-8-16)12-9-17;/h3-6,14H,7-12H2,1-2H3;1H