4-[bis(2-bromoethyl)amino]phenol; 3-chloranylbenzoic acid

Systemtic Name: 4-[bis(2-bromoethyl)amino]phenol; 3-chloranylbenzoic acid Openeye Name: 4-[bis(2-bromoethyl)amino]phenol; 3-chlorobenzoic acid CAS Name: 4-[bis(2-bromoethyl)amino]phenol; 3-chlorobenzoic acid IUPAC Name: 4-[bis(2-bromoethyl)amino]phenol; 3-chlorobenzoic acid Traditional Name: 4-[bis(2-bromoethyl)amino]phenol; 3-chlorobenzoic acid Formula: C17H18Br2ClNO3 MolecularWeight: 479.59072

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Cl)C(=O)O.C1=CC(=CC=C1N(CCBr)CCBr)O

Isomeric SMILES

C1=CC(=CC(=C1)Cl)C(=O)O.C1=CC(=CC=C1N(CCBr)CCBr)O

InChI

InChI=1S/C10H13Br2NO.C7H5ClO2/c11-5-7-13(8-6-12)9-1-3-10(14)4-2-9;8-6-3-1-2-5(4-6)7(9)10/h1-4,14H,5-8H2;1-4H,(H,9,10)