6-[[6-methyl-4-oxidanylidene-5-(phenylmethyl)-1H-pyrimidin-2-yl]amino]hexylazanium

Systemtic Name: 6-[[6-methyl-4-oxidanylidene-5-(phenylmethyl)-1H-pyrimidin-2-yl]amino]hexylazanium Openeye Name: 6-[(5-benzyl-6-methyl-4-oxo-1H-pyrimidin-2-yl)amino]hexylammonium CAS Name: 6-[[6-methyl-4-oxo-5-(phenylmethyl)-1H-pyrimidin-2-yl]amino]hexylammonium IUPAC Name: 6-[(5-benzyl-6-methyl-4-oxo-1H-pyrimidin-2-yl)amino]hexylazanium Traditional Name: 6-[(5-benzyl-4-keto-6-methyl-1H-pyrimidin-2-yl)amino]hexylammonium Formula: C18H27N4O+ MolecularWeight: 315.43318

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N=C(N1)NCCCCCC[NH3+])CC2=CC=CC=C2

Isomeric SMILES

CC1=C(C(=O)N=C(N1)NCCCCCC[NH3+])CC2=CC=CC=C2

InChI

InChI=1S/C18H26N4O/c1-14-16(13-15-9-5-4-6-10-15)17(23)22-18(21-14)20-12-8-3-2-7-11-19/h4-6,9-10H,2-3,7-8,11-13,19H2,1H3,(H2,20,21,22,23)/p+1