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

Systemtic Name: 4-[[4-[bis(2-chloroethyl)amino]phenoxy]carbonylamino]benzoic acid Openeye Name: 4-[[4-[bis(2-chloroethyl)amino]phenoxy]carbonylamino]benzoic acid CAS Name: 4-[[[4-[bis(2-chloroethyl)amino]phenoxy]-oxomethyl]amino]benzoic acid IUPAC Name: 4-[[4-[bis(2-chloroethyl)amino]phenoxy]carbonylamino]benzoic acid Traditional Name: 4-[[4-[bis(2-chloroethyl)amino]phenoxy]carbonylamino]benzoic acid Formula: C18H18Cl2N2O4 MolecularWeight: 397.25252

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)O)NC(=O)OC2=CC=C(C=C2)N(CCCl)CCCl

Isomeric SMILES

C1=CC(=CC=C1C(=O)O)NC(=O)OC2=CC=C(C=C2)N(CCCl)CCCl

InChI

InChI=1S/C18H18Cl2N2O4/c19-9-11-22(12-10-20)15-5-7-16(8-6-15)26-18(25)21-14-3-1-13(2-4-14)17(23)24/h1-8H,9-12H2,(H,21,25)(H,23,24)