2-azanyl-3-[5-[bis(2-chloroethyl)amino]-1-methyl-benzimidazol-2-yl]propanoic acid

Systemtic Name: 2-azanyl-3-[5-[bis(2-chloroethyl)amino]-1-methyl-benzimidazol-2-yl]propanoic acid Openeye Name: 2-amino-3-[5-[bis(2-chloroethyl)amino]-1-methyl-benzimidazol-2-yl]propanoic acid CAS Name: 2-amino-3-[5-[bis(2-chloroethyl)amino]-1-methyl-2-benzimidazolyl]propanoic acid IUPAC Name: 2-amino-3-[5-[bis(2-chloroethyl)amino]-1-methylbenzimidazol-2-yl]propanoic acid Traditional Name: 2-amino-3-[5-[bis(2-chloroethyl)amino]-1-methyl-benzimidazol-2-yl]propionic acid Formula: C15H20Cl2N4O2 MolecularWeight: 359.2509

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)N(CCCl)CCCl)N=C1CC(C(=O)O)N

Isomeric SMILES

CN1C2=C(C=C(C=C2)N(CCCl)CCCl)N=C1CC(C(=O)O)N

InChI

InChI=1S/C15H20Cl2N4O2/c1-20-13-3-2-10(21(6-4-16)7-5-17)8-12(13)19-14(20)9-11(18)15(22)23/h2-3,8,11H,4-7,9,18H2,1H3,(H,22,23)