2-[bis(2-chloroethyl)amino]-3-methyl-benzoic acid

Systemtic Name: 2-[bis(2-chloroethyl)amino]-3-methyl-benzoic acid Openeye Name: 2-[bis(2-chloroethyl)amino]-3-methyl-benzoic acid CAS Name: 2-[bis(2-chloroethyl)amino]-3-methylbenzoic acid IUPAC Name: 2-[bis(2-chloroethyl)amino]-3-methylbenzoic acid Traditional Name: 2-[bis(2-chloroethyl)amino]-3-methyl-benzoic acid Formula: C12H15Cl2NO2 MolecularWeight: 276.159

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1N(CCCl)CCCl)C(=O)O

Isomeric SMILES

CC1=CC=CC(=C1N(CCCl)CCCl)C(=O)O

InChI

InChI=1S/C12H15Cl2NO2/c1-9-3-2-4-10(12(16)17)11(9)15(7-5-13)8-6-14/h2-4H,5-8H2,1H3,(H,16,17)