N-(2-piperidin-1-ylethyl)-9-[8-[[4-(2-piperidin-1-ylethylcarbamoyl)acridin-9-yl]amino]octylamino]acridine-4-carboxamide

Systemtic Name: N-(2-piperidin-1-ylethyl)-9-[8-[[4-(2-piperidin-1-ylethylcarbamoyl)acridin-9-yl]amino]octylamino]acridine-4-carboxamide Openeye Name: N-[2-(1-piperidyl)ethyl]-9-[8-[[4-[2-(1-piperidyl)ethylcarbamoyl]acridin-9-yl]amino]octylamino]acridine-4-carboxamide CAS Name: 9-[8-[[4-[oxo-[2-(1-piperidinyl)ethylamino]methyl]-9-acridinyl]amino]octylamino]-N-[2-(1-piperidinyl)ethyl]-4-acridinecarboxamide IUPAC Name: N-(2-piperidin-1-ylethyl)-9-[8-[[4-(2-piperidin-1-ylethylcarbamoyl)acridin-9-yl]amino]octylamino]acridine-4-carboxamide Traditional Name: N-(2-piperidinoethyl)-9-[8-[[4-(2-piperidinoethylcarbamoyl)acridin-9-yl]amino]octylamino]acridine-4-carboxamide Formula: C50H62N8O2 MolecularWeight: 807.07968

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCNC(=O)C2=CC=CC3=C(C4=CC=CC=C4N=C32)NCCCCCCCCNC5=C6C=CC=C(C6=NC7=CC=CC=C75)C(=O)NCCN8CCCCC8

Isomeric SMILES

C1CCN(CC1)CCNC(=O)C2=CC=CC3=C(C4=CC=CC=C4N=C32)NCCCCCCCCNC5=C6C=CC=C(C6=NC7=CC=CC=C75)C(=O)NCCN8CCCCC8

InChI

InChI=1S/C50H62N8O2/c59-49(53-29-35-57-31-13-5-14-32-57)41-23-17-21-39-45(37-19-7-9-25-43(37)55-47(39)41)51-27-11-3-1-2-4-12-28-52-46-38-20-8-10-26-44(38)56-48-40(46)22-18-24-42(48)50(60)54-30-36-58-33-15-6-16-34-58/h7-10,17-26H,1-6,11-16,27-36H2,(H,51,55)(H,52,56)(H,53,59)(H,54,60)