[9,10-bis(oxidanylidene)anthracen-2-yl]-methyl-di(propan-2-yl)azanium; phosphoric acid

Systemtic Name: [9,10-bis(oxidanylidene)anthracen-2-yl]-methyl-di(propan-2-yl)azanium; phosphoric acid Openeye Name: (9,10-dioxo-2-anthryl)-diisopropyl-methyl-ammonium; phosphoric acid CAS Name: (9,10-dioxo-2-anthracenyl)-methyl-di(propan-2-yl)ammonium; phosphoric acid IUPAC Name: (9,10-dioxoanthracen-2-yl)-methyl-di(propan-2-yl)azanium; phosphoric acid Traditional Name: (9,10-diketo-2-anthryl)-diisopropyl-methyl-ammonium; phosphoric acid Formula: C21H27NO6P+ MolecularWeight: 420.415941

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)[N+](C)(C1=CC2=C(C=C1)C(=O)C3=CC=CC=C3C2=O)C(C)C.OP(=O)(O)O

Isomeric SMILES

CC(C)[N+](C)(C1=CC2=C(C=C1)C(=O)C3=CC=CC=C3C2=O)C(C)C.OP(=O)(O)O

InChI

InChI=1S/C21H24NO2.H3O4P/c1-13(2)22(5,14(3)4)15-10-11-18-19(12-15)21(24)17-9-7-6-8-16(17)20(18)23;1-5(2,3)4/h6-14H,1-5H3;(H3,1,2,3,4)/q+1;