2-[[4-[bis(2-chloroethyl)amino]phenoxy]carbonylamino]butanoic acid

Systemtic Name: 2-[[4-[bis(2-chloroethyl)amino]phenoxy]carbonylamino]butanoic acid Openeye Name: 2-[[4-[bis(2-chloroethyl)amino]phenoxy]carbonylamino]butanoic acid CAS Name: 2-[[[4-[bis(2-chloroethyl)amino]phenoxy]-oxomethyl]amino]butanoic acid IUPAC Name: 2-[[4-[bis(2-chloroethyl)amino]phenoxy]carbonylamino]butanoic acid Traditional Name: 2-[[4-[bis(2-chloroethyl)amino]phenoxy]carbonylamino]butyric acid Formula: C15H20Cl2N2O4 MolecularWeight: 363.2363

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)O)NC(=O)OC1=CC=C(C=C1)N(CCCl)CCCl

Isomeric SMILES

CCC(C(=O)O)NC(=O)OC1=CC=C(C=C1)N(CCCl)CCCl

InChI

InChI=1S/C15H20Cl2N2O4/c1-2-13(14(20)21)18-15(22)23-12-5-3-11(4-6-12)19(9-7-16)10-8-17/h3-6,13H,2,7-10H2,1H3,(H,18,22)(H,20,21)