3-azanyl-1,3-dimethyl-6-[2-[(4-nitrophenyl)methylamino]ethyl]pyrimidin-3-ium-2,4-dione

Systemtic Name: 3-azanyl-1,3-dimethyl-6-[2-[(4-nitrophenyl)methylamino]ethyl]pyrimidin-3-ium-2,4-dione Openeye Name: 3-amino-1,3-dimethyl-6-[2-[(4-nitrophenyl)methylamino]ethyl]pyrimidin-3-ium-2,4-dione CAS Name: 3-amino-1,3-dimethyl-6-[2-[(4-nitrophenyl)methylamino]ethyl]pyrimidin-3-ium-2,4-dione IUPAC Name: 3-amino-1,3-dimethyl-6-[2-[(4-nitrophenyl)methylamino]ethyl]pyrimidin-3-ium-2,4-dione Traditional Name: 3-amino-1,3-dimethyl-6-[2-[(4-nitrobenzyl)amino]ethyl]pyrimidin-3-ium-2,4-quinone Formula: C15H20N5O4+ MolecularWeight: 334.3504

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC(=O)[N+](C1=O)(C)N)CCNCC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CN1C(=CC(=O)[N+](C1=O)(C)N)CCNCC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C15H20N5O4/c1-18-13(9-14(21)20(2,16)15(18)22)7-8-17-10-11-3-5-12(6-4-11)19(23)24/h3-6,9,17H,7-8,10,16H2,1-2H3/q+1