N1,N3-bis[4-benzamido-9,10-bis(oxidanylidene)anthracen-1-yl]benzene-1,3-dicarboxamide

Systemtic Name: N1,N3-bis[4-benzamido-9,10-bis(oxidanylidene)anthracen-1-yl]benzene-1,3-dicarboxamide Openeye Name: N1,N3-bis(4-benzamido-9,10-dioxo-1-anthryl)benzene-1,3-dicarboxamide CAS Name: N1,N3-bis(4-benzamido-9,10-dioxo-1-anthracenyl)benzene-1,3-dicarboxamide IUPAC Name: 1-N,3-N-bis(4-benzamido-9,10-dioxoanthracen-1-yl)benzene-1,3-dicarboxamide Traditional Name: N,N'-bis(4-benzamido-9,10-diketo-1-anthryl)isophthalamide Formula: C50H30N4O8 MolecularWeight: 814.7952

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)NC2=C3C(=C(C=C2)NC(=O)C4=CC(=CC=C4)C(=O)NC5=C6C(=C(C=C5)NC(=O)C7=CC=CC=C7)C(=O)C8=CC=CC=C8C6=O)C(=O)C9=CC=CC=C9C3=O

Isomeric SMILES

C1=CC=C(C=C1)C(=O)NC2=C3C(=C(C=C2)NC(=O)C4=CC(=CC=C4)C(=O)NC5=C6C(=C(C=C5)NC(=O)C7=CC=CC=C7)C(=O)C8=CC=CC=C8C6=O)C(=O)C9=CC=CC=C9C3=O

InChI

InChI=1S/C50H30N4O8/c55-43-31-18-7-9-20-33(31)45(57)41-37(24-22-35(39(41)43)51-47(59)27-12-3-1-4-13-27)53-49(61)29-16-11-17-30(26-29)50(62)54-38-25-23-36(52-48(60)28-14-5-2-6-15-28)40-42(38)46(58)34-21-10-8-19-32(34)44(40)56/h1-26H,(H,51,59)(H,52,60)(H,53,61)(H,54,62)