6-[3-(4-aminophenyl)propyl]-1,3-dimethyl-5-propyl-1-(propylamino)pyrimidin-1-ium-2,4-dione

Systemtic Name: 6-[3-(4-aminophenyl)propyl]-1,3-dimethyl-5-propyl-1-(propylamino)pyrimidin-1-ium-2,4-dione Openeye Name: 6-[3-(4-aminophenyl)propyl]-1,3-dimethyl-5-propyl-1-(propylamino)pyrimidin-1-ium-2,4-dione CAS Name: 6-[3-(4-aminophenyl)propyl]-1,3-dimethyl-5-propyl-1-(propylamino)pyrimidin-1-ium-2,4-dione IUPAC Name: 6-[3-(4-aminophenyl)propyl]-1,3-dimethyl-5-propyl-1-(propylamino)pyrimidin-1-ium-2,4-dione Traditional Name: 6-[3-(4-aminophenyl)propyl]-1,3-dimethyl-5-propyl-1-(propylamino)pyrimidin-1-ium-2,4-quinone Formula: C21H33N4O2+ MolecularWeight: 373.51232

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C([N+](C(=O)N(C1=O)C)(C)NCCC)CCCC2=CC=C(C=C2)N

Isomeric SMILES

CCCC1=C([N+](C(=O)N(C1=O)C)(C)NCCC)CCCC2=CC=C(C=C2)N

InChI

InChI=1S/C21H33N4O2/c1-5-8-18-19(10-7-9-16-11-13-17(22)14-12-16)25(4,23-15-6-2)21(27)24(3)20(18)26/h11-14,23H,5-10,15,22H2,1-4H3/q+1