[6-(2,4-dimethylphenyl)-2-pyrrolidin-1-yl-pyrimidin-4-yl]methylazanium

Systemtic Name: [6-(2,4-dimethylphenyl)-2-pyrrolidin-1-yl-pyrimidin-4-yl]methylazanium Openeye Name: [6-(2,4-dimethylphenyl)-2-pyrrolidin-1-yl-pyrimidin-4-yl]methylammonium CAS Name: [6-(2,4-dimethylphenyl)-2-(1-pyrrolidinyl)-4-pyrimidinyl]methylammonium IUPAC Name: [6-(2,4-dimethylphenyl)-2-pyrrolidin-1-ylpyrimidin-4-yl]methylazanium Traditional Name: [6-(2,4-dimethylphenyl)-2-pyrrolidino-pyrimidin-4-yl]methylammonium Formula: C17H23N4+ MolecularWeight: 283.39132

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C2=CC(=NC(=N2)N3CCCC3)C[NH3+])C

Isomeric SMILES

CC1=CC(=C(C=C1)C2=CC(=NC(=N2)N3CCCC3)C[NH3+])C

InChI

InChI=1S/C17H22N4/c1-12-5-6-15(13(2)9-12)16-10-14(11-18)19-17(20-16)21-7-3-4-8-21/h5-6,9-10H,3-4,7-8,11,18H2,1-2H3/p+1