3-[(1,5-dimethylpyrazol-4-yl)carbonyl-(pyridin-3-ylmethyl)amino]propylazanium

Systemtic Name: 3-[(1,5-dimethylpyrazol-4-yl)carbonyl-(pyridin-3-ylmethyl)amino]propylazanium Openeye Name: 3-[(1,5-dimethylpyrazole-4-carbonyl)-(3-pyridylmethyl)amino]propylammonium CAS Name: 3-[[(1,5-dimethyl-4-pyrazolyl)-oxomethyl]-(3-pyridinylmethyl)amino]propylammonium IUPAC Name: 3-[(1,5-dimethylpyrazole-4-carbonyl)-(pyridin-3-ylmethyl)amino]propylazanium Traditional Name: 3-[(1,5-dimethylpyrazole-4-carbonyl)-(3-pyridylmethyl)amino]propylammonium Formula: C15H22N5O+ MolecularWeight: 288.36808

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1C)C(=O)N(CCC[NH3+])CC2=CN=CC=C2

Isomeric SMILES

CC1=C(C=NN1C)C(=O)N(CCC[NH3+])CC2=CN=CC=C2

InChI

InChI=1S/C15H21N5O/c1-12-14(10-18-19(12)2)15(21)20(8-4-6-16)11-13-5-3-7-17-9-13/h3,5,7,9-10H,4,6,8,11,16H2,1-2H3/p+1