[2-oxidanylidene-2-[phenethyl-(phenylmethyl)amino]ethyl] 5-bromanyl-2-oxidanyl-benzoate

Systemtic Name: [2-oxidanylidene-2-[phenethyl-(phenylmethyl)amino]ethyl] 5-bromanyl-2-oxidanyl-benzoate Openeye Name: [2-[benzyl(phenethyl)amino]-2-oxo-ethyl] 5-bromo-2-hydroxy-benzoate CAS Name: 5-bromo-2-hydroxybenzoic acid [2-oxo-2-[phenethyl-(phenylmethyl)amino]ethyl] ester IUPAC Name: [2-[benzyl(phenethyl)amino]-2-oxoethyl] 5-bromo-2-hydroxybenzoate Traditional Name: 5-bromo-2-hydroxy-benzoic acid [2-[benzyl(phenethyl)amino]-2-keto-ethyl] ester Formula: C24H22BrNO4 MolecularWeight: 468.33978

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCN(CC2=CC=CC=C2)C(=O)COC(=O)C3=C(C=CC(=C3)Br)O

Isomeric SMILES

C1=CC=C(C=C1)CCN(CC2=CC=CC=C2)C(=O)COC(=O)C3=C(C=CC(=C3)Br)O

InChI

InChI=1S/C24H22BrNO4/c25-20-11-12-22(27)21(15-20)24(29)30-17-23(28)26(16-19-9-5-2-6-10-19)14-13-18-7-3-1-4-8-18/h1-12,15,27H,13-14,16-17H2