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

Systemtic Name: 2-azanyl-5-[4-[bis(2-chloroethyl)amino]phenyl]pentanoic acid Openeye Name: 2-amino-5-[4-[bis(2-chloroethyl)amino]phenyl]pentanoic acid CAS Name: 2-amino-5-[4-[bis(2-chloroethyl)amino]phenyl]pentanoic acid IUPAC Name: 2-amino-5-[4-[bis(2-chloroethyl)amino]phenyl]pentanoic acid Traditional Name: 2-amino-5-[4-[bis(2-chloroethyl)amino]phenyl]valeric acid Formula: C15H22Cl2N2O2 MolecularWeight: 333.25338

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CCCC(C(=O)O)N)N(CCCl)CCCl

Isomeric SMILES

C1=CC(=CC=C1CCCC(C(=O)O)N)N(CCCl)CCCl

InChI

InChI=1S/C15H22Cl2N2O2/c16-8-10-19(11-9-17)13-6-4-12(5-7-13)2-1-3-14(18)15(20)21/h4-7,14H,1-3,8-11,18H2,(H,20,21)