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

Systemtic Name: 2-[2,5-bis(oxidanylidene)pyrrol-1-yl]-3-phenyl-propanoic acid; diphenyltin Openeye Name: 2-(2,5-dioxopyrrol-1-yl)-3-phenyl-propanoic acid; diphenyltin CAS Name: 2-(2,5-dioxo-1-pyrrolyl)-3-phenylpropanoic acid; diphenyltin IUPAC Name: 2-(2,5-dioxopyrrol-1-yl)-3-phenylpropanoic acid; diphenyltin Traditional Name: diphenyltin; 2-maleimido-3-phenyl-propionic acid Formula: C38H32N2O8Sn MolecularWeight: 763.37928

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)O)N2C(=O)C=CC2=O.C1=CC=C(C=C1)CC(C(=O)O)N2C(=O)C=CC2=O.C1=CC=C(C=C1)[Sn]C2=CC=CC=C2

Isomeric SMILES

C1=CC=C(C=C1)CC(C(=O)O)N2C(=O)C=CC2=O.C1=CC=C(C=C1)CC(C(=O)O)N2C(=O)C=CC2=O.C1=CC=C(C=C1)[Sn]C2=CC=CC=C2

InChI

InChI=1S/2C13H11NO4.2C6H5.Sn/c2*15-11-6-7-12(16)14(11)10(13(17)18)8-9-4-2-1-3-5-9;2*1-2-4-6-5-3-1;/h2*1-7,10H,8H2,(H,17,18);2*1-5H;