(2R)-2-(azocan-1-ium-1-yl)-N-[9,10-bis(oxidanylidene)anthracen-2-yl]propanamide

Systemtic Name: (2R)-2-(azocan-1-ium-1-yl)-N-[9,10-bis(oxidanylidene)anthracen-2-yl]propanamide Openeye Name: (2R)-2-(azocan-1-ium-1-yl)-N-(9,10-dioxo-2-anthryl)propanamide CAS Name: (2R)-2-(1-azocan-1-iumyl)-N-(9,10-dioxo-2-anthracenyl)propanamide IUPAC Name: (2R)-2-(azocan-1-ium-1-yl)-N-(9,10-dioxoanthracen-2-yl)propanamide Traditional Name: (2R)-2-(azocan-1-ium-1-yl)-N-(9,10-diketo-2-anthryl)propionamide Formula: C24H27N2O3+ MolecularWeight: 391.48278

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC2=C(C=C1)C(=O)C3=CC=CC=C3C2=O)[NH+]4CCCCCCC4

Isomeric SMILES

C[C@H](C(=O)NC1=CC2=C(C=C1)C(=O)C3=CC=CC=C3C2=O)[NH+]4CCCCCCC4

InChI

InChI=1S/C24H26N2O3/c1-16(26-13-7-3-2-4-8-14-26)24(29)25-17-11-12-20-21(15-17)23(28)19-10-6-5-9-18(19)22(20)27/h5-6,9-12,15-16H,2-4,7-8,13-14H2,1H3,(H,25,29)/p+1/t16-/m1/s1