3-pyrrolidin-1-yl-N-[6-(3-pyrrolidin-1-ylpropanoylamino)acridin-10-ium-3-yl]propanamide iodide

Systemtic Name: 3-pyrrolidin-1-yl-N-[6-(3-pyrrolidin-1-ylpropanoylamino)acridin-10-ium-3-yl]propanamide iodide Openeye Name: 3-pyrrolidin-1-yl-N-[6-(3-pyrrolidin-1-ylpropanoylamino)acridin-10-ium-3-yl]propanamide iodide CAS Name: N-[6-[[1-oxo-3-(1-pyrrolidinyl)propyl]amino]-3-acridin-10-iumyl]-3-(1-pyrrolidinyl)propanamide iodide IUPAC Name: 3-pyrrolidin-1-yl-N-[6-(3-pyrrolidin-1-ylpropanoylamino)acridin-10-ium-3-yl]propanamide iodide Traditional Name: 3-pyrrolidino-N-[6-(3-pyrrolidinopropanoylamino)acridin-10-ium-3-yl]propionamide iodide Formula: C27H34IN5O2 MolecularWeight: 587.49563

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CCC(=O)NC2=CC3=C(C=C2)C=C4C=CC(=CC4=[NH+]3)NC(=O)CCN5CCCC5.[I-]

Isomeric SMILES

C1CCN(C1)CCC(=O)NC2=CC3=C(C=C2)C=C4C=CC(=CC4=[NH+]3)NC(=O)CCN5CCCC5.[I-]

InChI

InChI=1S/C27H33N5O2.HI/c33-26(9-15-31-11-1-2-12-31)28-22-7-5-20-17-21-6-8-23(19-25(21)30-24(20)18-22)29-27(34)10-16-32-13-3-4-14-32;/h5-8,17-19H,1-4,9-16H2,(H,28,33)(H,29,34);1H