[4-[bis(2-chloroethyl)amino]phenyl] 2-methylbenzoate

Systemtic Name: [4-[bis(2-chloroethyl)amino]phenyl] 2-methylbenzoate Openeye Name: [4-[bis(2-chloroethyl)amino]phenyl] 2-methylbenzoate CAS Name: 2-methylbenzoic acid [4-[bis(2-chloroethyl)amino]phenyl] ester IUPAC Name: [4-[bis(2-chloroethyl)amino]phenyl] 2-methylbenzoate Traditional Name: 2-methylbenzoic acid [4-[bis(2-chloroethyl)amino]phenyl] ester Formula: C18H19Cl2NO2 MolecularWeight: 352.25496

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)OC2=CC=C(C=C2)N(CCCl)CCCl

Isomeric SMILES

CC1=CC=CC=C1C(=O)OC2=CC=C(C=C2)N(CCCl)CCCl

InChI

InChI=1S/C18H19Cl2NO2/c1-14-4-2-3-5-17(14)18(22)23-16-8-6-15(7-9-16)21(12-10-19)13-11-20/h2-9H,10-13H2,1H3