4-(acridin-9-ylamino)-N-[4-[[4-(acridin-9-ylamino)phenyl]carbonylamino]butyl]benzamide

Systemtic Name: 4-(acridin-9-ylamino)-N-[4-[[4-(acridin-9-ylamino)phenyl]carbonylamino]butyl]benzamide Openeye Name: 4-(acridin-9-ylamino)-N-[4-[[4-(acridin-9-ylamino)benzoyl]amino]butyl]benzamide CAS Name: 4-(9-acridinylamino)-N-[4-[[[4-(9-acridinylamino)phenyl]-oxomethyl]amino]butyl]benzamide IUPAC Name: 4-(acridin-9-ylamino)-N-[4-[[4-(acridin-9-ylamino)benzoyl]amino]butyl]benzamide Traditional Name: 4-(acridin-9-ylamino)-N-[4-[[4-(acridin-9-ylamino)benzoyl]amino]butyl]benzamide Formula: C44H36N6O2 MolecularWeight: 680.79564

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C3C=CC=CC3=N2)NC4=CC=C(C=C4)C(=O)NCCCCNC(=O)C5=CC=C(C=C5)NC6=C7C=CC=CC7=NC8=CC=CC=C86

Isomeric SMILES

C1=CC=C2C(=C1)C(=C3C=CC=CC3=N2)NC4=CC=C(C=C4)C(=O)NCCCCNC(=O)C5=CC=C(C=C5)NC6=C7C=CC=CC7=NC8=CC=CC=C86

InChI

InChI=1S/C44H36N6O2/c51-43(29-19-23-31(24-20-29)47-41-33-11-1-5-15-37(33)49-38-16-6-2-12-34(38)41)45-27-9-10-28-46-44(52)30-21-25-32(26-22-30)48-42-35-13-3-7-17-39(35)50-40-18-8-4-14-36(40)42/h1-8,11-26H,9-10,27-28H2,(H,45,51)(H,46,52)(H,47,49)(H,48,50)