2-[4-[bis(2-chloroethyl)amino]phenoxy]-2-methyl-propanoic acid; N-cyclohexylcyclohexanamine

Systemtic Name: 2-[4-[bis(2-chloroethyl)amino]phenoxy]-2-methyl-propanoic acid; N-cyclohexylcyclohexanamine Openeye Name: 2-[4-[bis(2-chloroethyl)amino]phenoxy]-2-methyl-propanoic acid; N-cyclohexylcyclohexanamine CAS Name: 2-[4-[bis(2-chloroethyl)amino]phenoxy]-2-methylpropanoic acid; N-cyclohexylcyclohexanamine IUPAC Name: 2-[4-[bis(2-chloroethyl)amino]phenoxy]-2-methylpropanoic acid; N-cyclohexylcyclohexanamine Traditional Name: 2-[4-[bis(2-chloroethyl)amino]phenoxy]-2-methyl-propionic acid; dicyclohexylamine Formula: C26H42Cl2N2O3 MolecularWeight: 501.52928

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)O)OC1=CC=C(C=C1)N(CCCl)CCCl.C1CCC(CC1)NC2CCCCC2

Isomeric SMILES

CC(C)(C(=O)O)OC1=CC=C(C=C1)N(CCCl)CCCl.C1CCC(CC1)NC2CCCCC2

InChI

InChI=1S/C14H19Cl2NO3.C12H23N/c1-14(2,13(18)19)20-12-5-3-11(4-6-12)17(9-7-15)10-8-16;1-3-7-11(8-4-1)13-12-9-5-2-6-10-12/h3-6H,7-10H2,1-2H3,(H,18,19);11-13H,1-10H2