2-[5-[(4-methoxy-3-prop-2-enoxycarbonyl-phenyl)carbamoyl]-1-prop-2-enoxycarbonyl-pyrrolidin-3-yl]ethanethioate

Systemtic Name: 2-[5-[(4-methoxy-3-prop-2-enoxycarbonyl-phenyl)carbamoyl]-1-prop-2-enoxycarbonyl-pyrrolidin-3-yl]ethanethioate Openeye Name: 2-[1-allyloxycarbonyl-5-[(3-allyloxycarbonyl-4-methoxy-phenyl)carbamoyl]pyrrolidin-3-yl]ethanethioate CAS Name: 2-[5-[[4-methoxy-3-[oxo(prop-2-enoxy)methyl]anilino]-oxomethyl]-1-[oxo(prop-2-enoxy)methyl]-3-pyrrolidinyl]ethanethioate IUPAC Name: 2-[5-[(4-methoxy-3-prop-2-enoxycarbonylphenyl)carbamoyl]-1-prop-2-enoxycarbonylpyrrolidin-3-yl]ethanethioate Traditional Name: 2-[1-allyloxycarbonyl-5-[(3-allyloxycarbonyl-4-methoxy-phenyl)carbamoyl]pyrrolidin-3-yl]thioacetate Formula: C22H25N2O7S- MolecularWeight: 461.5081

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)C2CC(CN2C(=O)OCC=C)CC(=S)[O-])C(=O)OCC=C

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)C2CC(CN2C(=O)OCC=C)CC(=S)[O-])C(=O)OCC=C

InChI

InChI=1S/C22H26N2O7S/c1-4-8-30-21(27)16-12-15(6-7-18(16)29-3)23-20(26)17-10-14(11-19(25)32)13-24(17)22(28)31-9-5-2/h4-7,12,14,17H,1-2,8-11,13H2,3H3,(H,23,26)(H,25,32)/p-1