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

Systemtic Name: [4-[bis(2-bromoethyl)amino]phenyl] 4-methylbenzoate Openeye Name: [4-[bis(2-bromoethyl)amino]phenyl] 4-methylbenzoate CAS Name: 4-methylbenzoic acid [4-[bis(2-bromoethyl)amino]phenyl] ester IUPAC Name: [4-[bis(2-bromoethyl)amino]phenyl] 4-methylbenzoate Traditional Name: 4-methylbenzoic acid [4-[bis(2-bromoethyl)amino]phenyl] ester Formula: C18H19Br2NO2 MolecularWeight: 441.15696

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H19Br2NO2/c1-14-2-4-15(5-3-14)18(22)23-17-8-6-16(7-9-17)21(12-10-19)13-11-20/h2-9H,10-13H2,1H3