[2-[(4-tert-butylphenyl)amino]-2-oxidanylidene-ethyl] 4-bromanylbenzoate

Systemtic Name: [2-[(4-tert-butylphenyl)amino]-2-oxidanylidene-ethyl] 4-bromanylbenzoate Openeye Name: [2-(4-tert-butylanilino)-2-oxo-ethyl] 4-bromobenzoate CAS Name: 4-bromobenzoic acid [2-(4-tert-butylanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-tert-butylanilino)-2-oxoethyl] 4-bromobenzoate Traditional Name: 4-bromobenzoic acid [2-(4-tert-butylanilino)-2-keto-ethyl] ester Formula: C19H20BrNO3 MolecularWeight: 390.271

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)NC(=O)COC(=O)C2=CC=C(C=C2)Br

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)NC(=O)COC(=O)C2=CC=C(C=C2)Br

InChI

InChI=1S/C19H20BrNO3/c1-19(2,3)14-6-10-16(11-7-14)21-17(22)12-24-18(23)13-4-8-15(20)9-5-13/h4-11H,12H2,1-3H3,(H,21,22)