[4-[bis(2-bromoethyl)amino]phenyl] 2,6-dimethylbenzoate

Systemtic Name: [4-[bis(2-bromoethyl)amino]phenyl] 2,6-dimethylbenzoate Openeye Name: [4-[bis(2-bromoethyl)amino]phenyl] 2,6-dimethylbenzoate CAS Name: 2,6-dimethylbenzoic acid [4-[bis(2-bromoethyl)amino]phenyl] ester IUPAC Name: [4-[bis(2-bromoethyl)amino]phenyl] 2,6-dimethylbenzoate Traditional Name: 2,6-dimethylbenzoic acid [4-[bis(2-bromoethyl)amino]phenyl] ester Formula: C19H21Br2NO2 MolecularWeight: 455.18354

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)C(=O)OC2=CC=C(C=C2)N(CCBr)CCBr

Isomeric SMILES

CC1=C(C(=CC=C1)C)C(=O)OC2=CC=C(C=C2)N(CCBr)CCBr

InChI

InChI=1S/C19H21Br2NO2/c1-14-4-3-5-15(2)18(14)19(23)24-17-8-6-16(7-9-17)22(12-10-20)13-11-21/h3-9H,10-13H2,1-2H3