[4-[(3,5-dimethyl-2-oxidanyl-phenyl)iminomethyl]phenyl] 3-bromanylbenzoate

Systemtic Name: [4-[(3,5-dimethyl-2-oxidanyl-phenyl)iminomethyl]phenyl] 3-bromanylbenzoate Openeye Name: [4-[(2-hydroxy-3,5-dimethyl-phenyl)iminomethyl]phenyl] 3-bromobenzoate CAS Name: 3-bromobenzoic acid [4-[(2-hydroxy-3,5-dimethylphenyl)iminomethyl]phenyl] ester IUPAC Name: [4-[(2-hydroxy-3,5-dimethylphenyl)iminomethyl]phenyl] 3-bromobenzoate Traditional Name: 3-bromobenzoic acid [4-[(2-hydroxy-3,5-dimethyl-phenyl)iminomethyl]phenyl] ester Formula: C22H18BrNO3 MolecularWeight: 424.28722

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)N=CC2=CC=C(C=C2)OC(=O)C3=CC(=CC=C3)Br)O)C

Isomeric SMILES

CC1=CC(=C(C(=C1)N=CC2=CC=C(C=C2)OC(=O)C3=CC(=CC=C3)Br)O)C

InChI

InChI=1S/C22H18BrNO3/c1-14-10-15(2)21(25)20(11-14)24-13-16-6-8-19(9-7-16)27-22(26)17-4-3-5-18(23)12-17/h3-13,25H,1-2H3