ethyl (E)-4-[(5-bromanyl-1-benzofuran-2-yl)carbonylamino]-5-(2-oxidanylidenepyrrolidin-3-yl)pent-2-enoate

Systemtic Name: ethyl (E)-4-[(5-bromanyl-1-benzofuran-2-yl)carbonylamino]-5-(2-oxidanylidenepyrrolidin-3-yl)pent-2-enoate Openeye Name: ethyl (E)-4-[(5-bromobenzofuran-2-carbonyl)amino]-5-(2-oxopyrrolidin-3-yl)pent-2-enoate CAS Name: (E)-4-[[(5-bromo-2-benzofuranyl)-oxomethyl]amino]-5-(2-oxo-3-pyrrolidinyl)-2-pentenoic acid ethyl ester IUPAC Name: ethyl (E)-4-[(5-bromo-1-benzofuran-2-carbonyl)amino]-5-(2-oxopyrrolidin-3-yl)pent-2-enoate Traditional Name: (E)-4-[(5-bromobenzofuran-2-carbonyl)amino]-5-(2-ketopyrrolidin-3-yl)pent-2-enoic acid ethyl ester Formula: C20H21BrN2O5 MolecularWeight: 449.29514

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=CC(CC1CCNC1=O)NC(=O)C2=CC3=C(O2)C=CC(=C3)Br

Isomeric SMILES

CCOC(=O)/C=C/C(CC1CCNC1=O)NC(=O)C2=CC3=C(O2)C=CC(=C3)Br

InChI

InChI=1S/C20H21BrN2O5/c1-2-27-18(24)6-4-15(10-12-7-8-22-19(12)25)23-20(26)17-11-13-9-14(21)3-5-16(13)28-17/h3-6,9,11-12,15H,2,7-8,10H2,1H3,(H,22,25)(H,23,26)/b6-4+