2-[2,5-bis(oxidanylidene)pyrrol-1-yl]-3-phenyl-propanoic acid; tributyltin

Systemtic Name: 2-[2,5-bis(oxidanylidene)pyrrol-1-yl]-3-phenyl-propanoic acid; tributyltin Openeye Name: 2-(2,5-dioxopyrrol-1-yl)-3-phenyl-propanoic acid; tributyltin CAS Name: 2-(2,5-dioxo-1-pyrrolyl)-3-phenylpropanoic acid; tributyltin IUPAC Name: 2-(2,5-dioxopyrrol-1-yl)-3-phenylpropanoic acid; tributyltin Traditional Name: 2-maleimido-3-phenyl-propionic acid; tributyltin Formula: C25H38NO4Sn MolecularWeight: 535.28352

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[Sn](CCCC)CCCC.C1=CC=C(C=C1)CC(C(=O)O)N2C(=O)C=CC2=O

Isomeric SMILES

CCCC[Sn](CCCC)CCCC.C1=CC=C(C=C1)CC(C(=O)O)N2C(=O)C=CC2=O

InChI

InChI=1S/C13H11NO4.3C4H9.Sn/c15-11-6-7-12(16)14(11)10(13(17)18)8-9-4-2-1-3-5-9;3*1-3-4-2;/h1-7,10H,8H2,(H,17,18);3*1,3-4H2,2H3;