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

Systemtic Name: [2-oxidanylidene-2-(pentan-3-ylamino)ethyl] 3-bromanyl-4-ethoxy-5-methoxy-benzoate Openeye Name: [2-(1-ethylpropylamino)-2-oxo-ethyl] 3-bromo-4-ethoxy-5-methoxy-benzoate CAS Name: 3-bromo-4-ethoxy-5-methoxybenzoic acid [2-oxo-2-(pentan-3-ylamino)ethyl] ester IUPAC Name: [2-oxo-2-(pentan-3-ylamino)ethyl] 3-bromo-4-ethoxy-5-methoxybenzoate Traditional Name: 3-bromo-4-ethoxy-5-methoxy-benzoic acid [2-(1-ethylpropylamino)-2-keto-ethyl] ester Formula: C17H24BrNO5 MolecularWeight: 402.28016

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)NC(=O)COC(=O)C1=CC(=C(C(=C1)Br)OCC)OC

Isomeric SMILES

CCC(CC)NC(=O)COC(=O)C1=CC(=C(C(=C1)Br)OCC)OC

InChI

InChI=1S/C17H24BrNO5/c1-5-12(6-2)19-15(20)10-24-17(21)11-8-13(18)16(23-7-3)14(9-11)22-4/h8-9,12H,5-7,10H2,1-4H3,(H,19,20)