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

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

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

Isomeric SMILES

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

InChI

InChI=1S/C13H17Cl2NO.ClH/c1-11(16(9-7-14)10-8-15)13(17)12-5-3-2-4-6-12;/h2-6,11H,7-10H2,1H3;1H