methyl 5-[bis(2-chloroethyl)aminomethyl]-2-ethoxy-benzoate hydrochloride

Systemtic Name: methyl 5-[bis(2-chloroethyl)aminomethyl]-2-ethoxy-benzoate hydrochloride Openeye Name: methyl 5-[bis(2-chloroethyl)aminomethyl]-2-ethoxy-benzoate hydrochloride CAS Name: 5-[bis(2-chloroethyl)aminomethyl]-2-ethoxybenzoic acid methyl ester hydrochloride IUPAC Name: methyl 5-[bis(2-chloroethyl)aminomethyl]-2-ethoxybenzoate hydrochloride Traditional Name: 5-[bis(2-chloroethyl)aminomethyl]-2-ethoxy-benzoic acid methyl ester hydrochloride Formula: C15H22Cl3NO3 MolecularWeight: 370.69908

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CN(CCCl)CCCl)C(=O)OC.Cl

Isomeric SMILES

CCOC1=C(C=C(C=C1)CN(CCCl)CCCl)C(=O)OC.Cl

InChI

InChI=1S/C15H21Cl2NO3.ClH/c1-3-21-14-5-4-12(10-13(14)15(19)20-2)11-18(8-6-16)9-7-17;/h4-5,10H,3,6-9,11H2,1-2H3;1H