methyl 2-azanyl-3-[3-[bis(2-chloroethyl)amino]-4-methoxy-phenyl]propanoate hydrochloride

Systemtic Name: methyl 2-azanyl-3-[3-[bis(2-chloroethyl)amino]-4-methoxy-phenyl]propanoate hydrochloride Openeye Name: methyl 2-amino-3-[3-[bis(2-chloroethyl)amino]-4-methoxy-phenyl]propanoate hydrochloride CAS Name: 2-amino-3-[3-[bis(2-chloroethyl)amino]-4-methoxyphenyl]propanoic acid methyl ester hydrochloride IUPAC Name: methyl 2-amino-3-[3-[bis(2-chloroethyl)amino]-4-methoxyphenyl]propanoate hydrochloride Traditional Name: 2-amino-3-[3-[bis(2-chloroethyl)amino]-4-methoxy-phenyl]propionic acid methyl ester hydrochloride Formula: C15H23Cl3N2O3 MolecularWeight: 385.71372

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CC(C(=O)OC)N)N(CCCl)CCCl.Cl

Isomeric SMILES

COC1=C(C=C(C=C1)CC(C(=O)OC)N)N(CCCl)CCCl.Cl

InChI

InChI=1S/C15H22Cl2N2O3.ClH/c1-21-14-4-3-11(9-12(18)15(20)22-2)10-13(14)19(7-5-16)8-6-17;/h3-4,10,12H,5-9,18H2,1-2H3;1H