4-[6-[bis(2-chloroethyl)amino]-3-methyl-1,2-dihydrobenzimidazol-2-yl]butanoic acid

Systemtic Name: 4-[6-[bis(2-chloroethyl)amino]-3-methyl-1,2-dihydrobenzimidazol-2-yl]butanoic acid Openeye Name: 4-[6-[bis(2-chloroethyl)amino]-3-methyl-1,2-dihydrobenzimidazol-2-yl]butanoic acid CAS Name: 4-[6-[bis(2-chloroethyl)amino]-3-methyl-1,2-dihydrobenzimidazol-2-yl]butanoic acid IUPAC Name: 4-[6-[bis(2-chloroethyl)amino]-3-methyl-1,2-dihydrobenzimidazol-2-yl]butanoic acid Traditional Name: 4-[6-[bis(2-chloroethyl)amino]-3-methyl-1,2-dihydrobenzimidazol-2-yl]butyric acid Formula: C16H23Cl2N3O2 MolecularWeight: 360.27872

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(NC2=C1C=CC(=C2)N(CCCl)CCCl)CCCC(=O)O

Isomeric SMILES

CN1C(NC2=C1C=CC(=C2)N(CCCl)CCCl)CCCC(=O)O

InChI

InChI=1S/C16H23Cl2N3O2/c1-20-14-6-5-12(21(9-7-17)10-8-18)11-13(14)19-15(20)3-2-4-16(22)23/h5-6,11,15,19H,2-4,7-10H2,1H3,(H,22,23)