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

Systemtic Name: (2R)-N-[9,10-bis(oxidanylidene)anthracen-2-yl]-2-isoquinolin-2-ium-2-yl-propanamide Openeye Name: (2R)-N-(9,10-dioxo-2-anthryl)-2-isoquinolin-2-ium-2-yl-propanamide CAS Name: (2R)-N-(9,10-dioxo-2-anthracenyl)-2-(2-isoquinolin-2-iumyl)propanamide IUPAC Name: (2R)-N-(9,10-dioxoanthracen-2-yl)-2-isoquinolin-2-ium-2-ylpropanamide Traditional Name: (2R)-N-(9,10-diketo-2-anthryl)-2-isoquinolin-2-ium-2-yl-propionamide Formula: C26H19N2O3+ MolecularWeight: 407.44066

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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)[N+]4=CC5=CC=CC=C5C=C4

Isomeric SMILES

C[C@H](C(=O)NC1=CC2=C(C=C1)C(=O)C3=CC=CC=C3C2=O)[N+]4=CC5=CC=CC=C5C=C4

InChI

InChI=1S/C26H18N2O3/c1-16(28-13-12-17-6-2-3-7-18(17)15-28)26(31)27-19-10-11-22-23(14-19)25(30)21-9-5-4-8-20(21)24(22)29/h2-16H,1H3/p+1/t16-/m1/s1