1-[(1-methyl-3-propyl-2H-imidazol-1-ium-1-yl)amino]-4-oxidanyl-anthracene-9,10-dione

Systemtic Name: 1-[(1-methyl-3-propyl-2H-imidazol-1-ium-1-yl)amino]-4-oxidanyl-anthracene-9,10-dione Openeye Name: 1-hydroxy-4-[(1-methyl-3-propyl-2H-imidazol-1-ium-1-yl)amino]anthracene-9,10-dione CAS Name: 1-hydroxy-4-[(1-methyl-3-propyl-2H-imidazol-1-ium-1-yl)amino]anthracene-9,10-dione IUPAC Name: 1-hydroxy-4-[(1-methyl-3-propyl-2H-imidazol-1-ium-1-yl)amino]anthracene-9,10-dione Traditional Name: 1-hydroxy-4-[(1-methyl-3-propyl-4-imidazolin-1-ium-1-yl)amino]-9,10-anthraquinone Formula: C21H22N3O3+ MolecularWeight: 364.41768

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C[N+](C=C1)(C)NC2=C3C(=C(C=C2)O)C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

CCCN1C[N+](C=C1)(C)NC2=C3C(=C(C=C2)O)C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C21H21N3O3/c1-3-10-23-11-12-24(2,13-23)22-16-8-9-17(25)19-18(16)20(26)14-6-4-5-7-15(14)21(19)27/h4-9,11-12H,3,10,13H2,1-2H3,(H-,22,25,26,27)/p+1