6-[2-(4-azanylphenoxy)ethyl]-1,3-dimethyl-1-(propan-2-ylamino)-5-propyl-pyrimidin-1-ium-2,4-dione

Systemtic Name: 6-[2-(4-azanylphenoxy)ethyl]-1,3-dimethyl-1-(propan-2-ylamino)-5-propyl-pyrimidin-1-ium-2,4-dione Openeye Name: 6-[2-(4-aminophenoxy)ethyl]-1-(isopropylamino)-1,3-dimethyl-5-propyl-pyrimidin-1-ium-2,4-dione CAS Name: 6-[2-(4-aminophenoxy)ethyl]-1,3-dimethyl-1-(propan-2-ylamino)-5-propylpyrimidin-1-ium-2,4-dione IUPAC Name: 6-[2-(4-aminophenoxy)ethyl]-1,3-dimethyl-1-(propan-2-ylamino)-5-propylpyrimidin-1-ium-2,4-dione Traditional Name: 6-[2-(4-aminophenoxy)ethyl]-1-(isopropylamino)-1,3-dimethyl-5-propyl-pyrimidin-1-ium-2,4-quinone Formula: C20H31N4O3+ MolecularWeight: 375.48514

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C([N+](C(=O)N(C1=O)C)(C)NC(C)C)CCOC2=CC=C(C=C2)N

Isomeric SMILES

CCCC1=C([N+](C(=O)N(C1=O)C)(C)NC(C)C)CCOC2=CC=C(C=C2)N

InChI

InChI=1S/C20H31N4O3/c1-6-7-17-18(12-13-27-16-10-8-15(21)9-11-16)24(5,22-14(2)3)20(26)23(4)19(17)25/h8-11,14,22H,6-7,12-13,21H2,1-5H3/q+1