9-oxidanylidene-N4,N5-bis[3-(3-pyrrolidin-1-ylpropanoylamino)phenyl]-10H-acridine-4,5-dicarboxamide

Systemtic Name: 9-oxidanylidene-N4,N5-bis[3-(3-pyrrolidin-1-ylpropanoylamino)phenyl]-10H-acridine-4,5-dicarboxamide Openeye Name: 9-oxo-N4,N5-bis[3-(3-pyrrolidin-1-ylpropanoylamino)phenyl]-10H-acridine-4,5-dicarboxamide CAS Name: 9-oxo-N4,N5-bis[3-[[1-oxo-3-(1-pyrrolidinyl)propyl]amino]phenyl]-10H-acridine-4,5-dicarboxamide IUPAC Name: 9-oxo-4-N,5-N-bis[3-(3-pyrrolidin-1-ylpropanoylamino)phenyl]-10H-acridine-4,5-dicarboxamide Traditional Name: 9-keto-N,N'-bis[3-(3-pyrrolidinopropanoylamino)phenyl]-10H-acridine-4,5-dicarboxamide Formula: C41H43N7O5 MolecularWeight: 713.82402

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CCC(=O)NC2=CC=CC(=C2)NC(=O)C3=CC=CC4=C3NC5=C(C4=O)C=CC=C5C(=O)NC6=CC(=CC=C6)NC(=O)CCN7CCCC7

Isomeric SMILES

C1CCN(C1)CCC(=O)NC2=CC=CC(=C2)NC(=O)C3=CC=CC4=C3NC5=C(C4=O)C=CC=C5C(=O)NC6=CC(=CC=C6)NC(=O)CCN7CCCC7

InChI

InChI=1S/C41H43N7O5/c49-35(17-23-47-19-1-2-20-47)42-27-9-5-11-29(25-27)44-40(52)33-15-7-13-31-37(33)46-38-32(39(31)51)14-8-16-34(38)41(53)45-30-12-6-10-28(26-30)43-36(50)18-24-48-21-3-4-22-48/h5-16,25-26H,1-4,17-24H2,(H,42,49)(H,43,50)(H,44,52)(H,45,53)(H,46,51)