[4-[bis(2-bromoethyl)amino]phenyl] 3-methoxybenzoate

Systemtic Name: [4-[bis(2-bromoethyl)amino]phenyl] 3-methoxybenzoate Openeye Name: [4-[bis(2-bromoethyl)amino]phenyl] 3-methoxybenzoate CAS Name: 3-methoxybenzoic acid [4-[bis(2-bromoethyl)amino]phenyl] ester IUPAC Name: [4-[bis(2-bromoethyl)amino]phenyl] 3-methoxybenzoate Traditional Name: 3-methoxybenzoic acid [4-[bis(2-bromoethyl)amino]phenyl] ester Formula: C18H19Br2NO3 MolecularWeight: 457.15636

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(=O)OC2=CC=C(C=C2)N(CCBr)CCBr

Isomeric SMILES

COC1=CC=CC(=C1)C(=O)OC2=CC=C(C=C2)N(CCBr)CCBr

InChI

InChI=1S/C18H19Br2NO3/c1-23-17-4-2-3-14(13-17)18(22)24-16-7-5-15(6-8-16)21(11-9-19)12-10-20/h2-8,13H,9-12H2,1H3