3-[bis(2-chloroethyl)amino]-1-phenyl-propan-1-one hydrochloride

Systemtic Name: 3-[bis(2-chloroethyl)amino]-1-phenyl-propan-1-one hydrochloride Openeye Name: 3-[bis(2-chloroethyl)amino]-1-phenyl-propan-1-one hydrochloride CAS Name: 3-[bis(2-chloroethyl)amino]-1-phenyl-1-propanone hydrochloride IUPAC Name: 3-[bis(2-chloroethyl)amino]-1-phenylpropan-1-one hydrochloride Traditional Name: 3-[bis(2-chloroethyl)amino]-1-phenyl-propan-1-one hydrochloride Formula: C13H18Cl3NO MolecularWeight: 310.64712

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H17Cl2NO.ClH/c14-7-10-16(11-8-15)9-6-13(17)12-4-2-1-3-5-12;/h1-5H,6-11H2;1H