3,3-bis[2,2-bis(4-pyrrolidin-1-ylphenyl)ethenyl]-6-pyrrolidin-1-yl-2-benzofuran-1-one

Systemtic Name: 3,3-bis[2,2-bis(4-pyrrolidin-1-ylphenyl)ethenyl]-6-pyrrolidin-1-yl-2-benzofuran-1-one Openeye Name: 3,3-bis[2,2-bis(4-pyrrolidin-1-ylphenyl)vinyl]-6-pyrrolidin-1-yl-isobenzofuran-1-one CAS Name: 3,3-bis[2,2-bis[4-(1-pyrrolidinyl)phenyl]ethenyl]-6-(1-pyrrolidinyl)-1-isobenzofuranone IUPAC Name: 3,3-bis[2,2-bis(4-pyrrolidin-1-ylphenyl)ethenyl]-6-pyrrolidin-1-yl-2-benzofuran-1-one Traditional Name: 3,3-bis[2,2-bis(4-pyrrolidinophenyl)vinyl]-6-pyrrolidino-phthalide Formula: C56H61N5O2 MolecularWeight: 836.11584

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=CC=C(C=C2)C(=CC3(C4=C(C=C(C=C4)N5CCCC5)C(=O)O3)C=C(C6=CC=C(C=C6)N7CCCC7)C8=CC=C(C=C8)N9CCCC9)C1=CC=C(C=C1)N1CCCC1

Isomeric SMILES

C1CCN(C1)C2=CC=C(C=C2)C(=CC3(C4=C(C=C(C=C4)N5CCCC5)C(=O)O3)C=C(C6=CC=C(C=C6)N7CCCC7)C8=CC=C(C=C8)N9CCCC9)C1=CC=C(C=C1)N1CCCC1

InChI

InChI=1S/C56H61N5O2/c62-55-51-39-50(61-37-9-10-38-61)27-28-54(51)56(63-55,40-52(42-11-19-46(20-12-42)57-29-1-2-30-57)43-13-21-47(22-14-43)58-31-3-4-32-58)41-53(44-15-23-48(24-16-44)59-33-5-6-34-59)45-17-25-49(26-18-45)60-35-7-8-36-60/h11-28,39-41H,1-10,29-38H2