phosphoric acid; 2-[1-(propan-2-ylamino)ethyl]anthracene-9,10-dione

Systemtic Name: phosphoric acid; 2-[1-(propan-2-ylamino)ethyl]anthracene-9,10-dione Openeye Name: 2-[1-(isopropylamino)ethyl]anthracene-9,10-dione; phosphoric acid CAS Name: phosphoric acid; 2-[1-(propan-2-ylamino)ethyl]anthracene-9,10-dione IUPAC Name: phosphoric acid; 2-[1-(propan-2-ylamino)ethyl]anthracene-9,10-dione Traditional Name: 2-[1-(isopropylamino)ethyl]-9,10-anthraquinone; phosphoric acid Formula: C19H22NO6P MolecularWeight: 391.354841

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(C)C1=CC2=C(C=C1)C(=O)C3=CC=CC=C3C2=O.OP(=O)(O)O

Isomeric SMILES

CC(C)NC(C)C1=CC2=C(C=C1)C(=O)C3=CC=CC=C3C2=O.OP(=O)(O)O

InChI

InChI=1S/C19H19NO2.H3O4P/c1-11(2)20-12(3)13-8-9-16-17(10-13)19(22)15-7-5-4-6-14(15)18(16)21;1-5(2,3)4/h4-12,20H,1-3H3;(H3,1,2,3,4)