5-[4-[bis(2-chloroethyl)amino]phenyl]pentanoic acid

Systemtic Name: 5-[4-[bis(2-chloroethyl)amino]phenyl]pentanoic acid Openeye Name: 5-[4-[bis(2-chloroethyl)amino]phenyl]pentanoic acid CAS Name: 5-[4-[bis(2-chloroethyl)amino]phenyl]pentanoic acid IUPAC Name: 5-[4-[bis(2-chloroethyl)amino]phenyl]pentanoic acid Traditional Name: 5-[4-[bis(2-chloroethyl)amino]phenyl]valeric acid Formula: C15H21Cl2NO2 MolecularWeight: 318.23874

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CCCCC(=O)O)N(CCCl)CCCl

Isomeric SMILES

C1=CC(=CC=C1CCCCC(=O)O)N(CCCl)CCCl

InChI

InChI=1S/C15H21Cl2NO2/c16-9-11-18(12-10-17)14-7-5-13(6-8-14)3-1-2-4-15(19)20/h5-8H,1-4,9-12H2,(H,19,20)