3-(acridin-9-ylamino)-N,N'-bis[6-(acridin-9-ylamino)hexyl]pentanediamide

Systemtic Name: 3-(acridin-9-ylamino)-N,N'-bis[6-(acridin-9-ylamino)hexyl]pentanediamide Openeye Name: 3-(acridin-9-ylamino)-N,N'-bis[6-(acridin-9-ylamino)hexyl]pentanediamide CAS Name: 3-(9-acridinylamino)-N,N'-bis[6-(9-acridinylamino)hexyl]pentanediamide IUPAC Name: 3-(acridin-9-ylamino)-N,N'-bis[6-(acridin-9-ylamino)hexyl]pentanediamide Traditional Name: 3-(acridin-9-ylamino)-N,N'-bis[6-(acridin-9-ylamino)hexyl]glutaramide Formula: C56H58N8O2 MolecularWeight: 875.11212

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C3C=CC=CC3=N2)NCCCCCCNC(=O)CC(CC(=O)NCCCCCCNC4=C5C=CC=CC5=NC6=CC=CC=C64)NC7=C8C=CC=CC8=NC9=CC=CC=C97

Isomeric SMILES

C1=CC=C2C(=C1)C(=C3C=CC=CC3=N2)NCCCCCCNC(=O)CC(CC(=O)NCCCCCCNC4=C5C=CC=CC5=NC6=CC=CC=C64)NC7=C8C=CC=CC8=NC9=CC=CC=C97

InChI

InChI=1S/C56H58N8O2/c65-52(57-33-17-1-3-19-35-59-54-40-21-5-11-27-46(40)62-47-28-12-6-22-41(47)54)37-39(61-56-44-25-9-15-31-50(44)64-51-32-16-10-26-45(51)56)38-53(66)58-34-18-2-4-20-36-60-55-42-23-7-13-29-48(42)63-49-30-14-8-24-43(49)55/h5-16,21-32,39H,1-4,17-20,33-38H2,(H,57,65)(H,58,66)(H,59,62)(H,60,63)(H,61,64)