[2-(butylamino)-2-oxidanylidene-ethyl] 3-bromanyl-5-ethoxy-4-methoxy-benzoate

Systemtic Name: [2-(butylamino)-2-oxidanylidene-ethyl] 3-bromanyl-5-ethoxy-4-methoxy-benzoate Openeye Name: [2-(butylamino)-2-oxo-ethyl] 3-bromo-5-ethoxy-4-methoxy-benzoate CAS Name: 3-bromo-5-ethoxy-4-methoxybenzoic acid [2-(butylamino)-2-oxoethyl] ester IUPAC Name: [2-(butylamino)-2-oxoethyl] 3-bromo-5-ethoxy-4-methoxybenzoate Traditional Name: 3-bromo-5-ethoxy-4-methoxy-benzoic acid [2-(butylamino)-2-keto-ethyl] ester Formula: C16H22BrNO5 MolecularWeight: 388.25358

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)COC(=O)C1=CC(=C(C(=C1)Br)OC)OCC

Isomeric SMILES

CCCCNC(=O)COC(=O)C1=CC(=C(C(=C1)Br)OC)OCC

InChI

InChI=1S/C16H22BrNO5/c1-4-6-7-18-14(19)10-23-16(20)11-8-12(17)15(21-3)13(9-11)22-5-2/h8-9H,4-7,10H2,1-3H3,(H,18,19)