6-pyrrolidin-1-yl-N-[6-(6-pyrrolidin-1-ylhexanoylamino)-9-[[4-(3-pyrrolidin-1-ylpropanoylamino)phenyl]amino]acridin-3-yl]hexanamide

Systemtic Name: 6-pyrrolidin-1-yl-N-[6-(6-pyrrolidin-1-ylhexanoylamino)-9-[[4-(3-pyrrolidin-1-ylpropanoylamino)phenyl]amino]acridin-3-yl]hexanamide Openeye Name: 6-pyrrolidin-1-yl-N-[6-(6-pyrrolidin-1-ylhexanoylamino)-9-[4-(3-pyrrolidin-1-ylpropanoylamino)anilino]acridin-3-yl]hexanamide CAS Name: N-[6-[[1-oxo-6-(1-pyrrolidinyl)hexyl]amino]-9-[4-[[1-oxo-3-(1-pyrrolidinyl)propyl]amino]anilino]-3-acridinyl]-6-(1-pyrrolidinyl)hexanamide IUPAC Name: 6-pyrrolidin-1-yl-N-[6-(6-pyrrolidin-1-ylhexanoylamino)-9-[4-(3-pyrrolidin-1-ylpropanoylamino)anilino]acridin-3-yl]hexanamide Traditional Name: 6-pyrrolidino-N-[6-(6-pyrrolidinohexanoylamino)-9-[4-(3-pyrrolidinopropanoylamino)anilino]acridin-3-yl]hexanamide Formula: C46H62N8O3 MolecularWeight: 775.03628

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CCCCCC(=O)NC2=CC3=C(C=C2)C(=C4C=CC(=CC4=N3)NC(=O)CCCCCN5CCCC5)NC6=CC=C(C=C6)NC(=O)CCN7CCCC7

Isomeric SMILES

C1CCN(C1)CCCCCC(=O)NC2=CC3=C(C=C2)C(=C4C=CC(=CC4=N3)NC(=O)CCCCCN5CCCC5)NC6=CC=C(C=C6)NC(=O)CCN7CCCC7

InChI

InChI=1S/C46H62N8O3/c55-43(13-3-1-5-24-52-26-7-8-27-52)48-37-19-21-39-41(33-37)51-42-34-38(49-44(56)14-4-2-6-25-53-28-9-10-29-53)20-22-40(42)46(39)50-36-17-15-35(16-18-36)47-45(57)23-32-54-30-11-12-31-54/h15-22,33-34H,1-14,23-32H2,(H,47,57)(H,48,55)(H,49,56)(H,50,51)