N-[4-chloranyl-9,10-bis(oxidanylidene)anthracen-1-yl]-4-hexyl-benzamide

Systemtic Name: N-[4-chloranyl-9,10-bis(oxidanylidene)anthracen-1-yl]-4-hexyl-benzamide Openeye Name: N-(4-chloro-9,10-dioxo-1-anthryl)-4-hexyl-benzamide CAS Name: N-(4-chloro-9,10-dioxo-1-anthracenyl)-4-hexylbenzamide IUPAC Name: N-(4-chloro-9,10-dioxoanthracen-1-yl)-4-hexylbenzamide Traditional Name: N-(4-chloro-9,10-diketo-1-anthryl)-4-hexyl-benzamide Formula: C27H24ClNO3 MolecularWeight: 445.93736

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC=C(C=C1)C(=O)NC2=C3C(=C(C=C2)Cl)C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

CCCCCCC1=CC=C(C=C1)C(=O)NC2=C3C(=C(C=C2)Cl)C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C27H24ClNO3/c1-2-3-4-5-8-17-11-13-18(14-12-17)27(32)29-22-16-15-21(28)23-24(22)26(31)20-10-7-6-9-19(20)25(23)30/h6-7,9-16H,2-5,8H2,1H3,(H,29,32)