[2-[(4-bromanyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl] 2-(2-oxidanylidene-3-propyl-benzimidazol-1-yl)ethanoate

Systemtic Name: [2-[(4-bromanyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl] 2-(2-oxidanylidene-3-propyl-benzimidazol-1-yl)ethanoate Openeye Name: [2-(4-bromo-2-methyl-anilino)-2-oxo-ethyl] 2-(2-oxo-3-propyl-benzimidazol-1-yl)acetate CAS Name: 2-(2-oxo-3-propyl-1-benzimidazolyl)acetic acid [2-(4-bromo-2-methylanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-bromo-2-methylanilino)-2-oxoethyl] 2-(2-oxo-3-propylbenzimidazol-1-yl)acetate Traditional Name: 2-(2-keto-3-propyl-benzimidazol-1-yl)acetic acid [2-(4-bromo-2-methyl-anilino)-2-keto-ethyl] ester Formula: C21H22BrN3O4 MolecularWeight: 460.32108

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=CC=CC=C2N(C1=O)CC(=O)OCC(=O)NC3=C(C=C(C=C3)Br)C

Isomeric SMILES

CCCN1C2=CC=CC=C2N(C1=O)CC(=O)OCC(=O)NC3=C(C=C(C=C3)Br)C

InChI

InChI=1S/C21H22BrN3O4/c1-3-10-24-17-6-4-5-7-18(17)25(21(24)28)12-20(27)29-13-19(26)23-16-9-8-15(22)11-14(16)2/h4-9,11H,3,10,12-13H2,1-2H3,(H,23,26)