diethyl-[2-[(2R)-3-[(7-methoxy-1-benzofuran-2-yl)carbonyl]-4-oxidanyl-5-oxidanylidene-2-thiophen-2-yl-2H-pyrrol-1-yl]ethyl]azanium

Systemtic Name: diethyl-[2-[(2R)-3-[(7-methoxy-1-benzofuran-2-yl)carbonyl]-4-oxidanyl-5-oxidanylidene-2-thiophen-2-yl-2H-pyrrol-1-yl]ethyl]azanium Openeye Name: diethyl-[2-[(2R)-4-hydroxy-3-(7-methoxybenzofuran-2-carbonyl)-5-oxo-2-(2-thienyl)-2H-pyrrol-1-yl]ethyl]ammonium CAS Name: diethyl-[2-[(2R)-4-hydroxy-3-[(7-methoxy-2-benzofuranyl)-oxomethyl]-5-oxo-2-thiophen-2-yl-2H-pyrrol-1-yl]ethyl]ammonium IUPAC Name: diethyl-[2-[(2R)-4-hydroxy-3-(7-methoxy-1-benzofuran-2-carbonyl)-5-oxo-2-thiophen-2-yl-2H-pyrrol-1-yl]ethyl]azanium Traditional Name: diethyl-[2-[(5R)-3-hydroxy-2-keto-4-(7-methoxybenzofuran-2-carbonyl)-5-(2-thienyl)-3-pyrrolin-1-yl]ethyl]ammonium Formula: C24H27N2O5S+ MolecularWeight: 455.54658

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCN1C(C(=C(C1=O)O)C(=O)C2=CC3=C(O2)C(=CC=C3)OC)C4=CC=CS4

Isomeric SMILES

CC[NH+](CC)CCN1[C@H](C(=C(C1=O)O)C(=O)C2=CC3=C(O2)C(=CC=C3)OC)C4=CC=CS4

InChI

InChI=1S/C24H26N2O5S/c1-4-25(5-2)11-12-26-20(18-10-7-13-32-18)19(22(28)24(26)29)21(27)17-14-15-8-6-9-16(30-3)23(15)31-17/h6-10,13-14,20,28H,4-5,11-12H2,1-3H3/p+1/t20-/m0/s1