4-azanyl-1,2-dimethyl-5-pentadecyl-pyrazol-3-one hydrochloride

Systemtic Name: 4-azanyl-1,2-dimethyl-5-pentadecyl-pyrazol-3-one hydrochloride Openeye Name: 4-amino-1,2-dimethyl-5-pentadecyl-pyrazol-3-one hydrochloride CAS Name: 4-amino-1,2-dimethyl-5-pentadecyl-3-pyrazolone hydrochloride IUPAC Name: 4-amino-1,2-dimethyl-5-pentadecylpyrazol-3-one hydrochloride Traditional Name: 4-amino-1,2-dimethyl-5-pentadecyl-3-pyrazolin-3-one hydrochloride Formula: C20H40ClN3O MolecularWeight: 374.0041

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC1=C(C(=O)N(N1C)C)N.Cl

Isomeric SMILES

CCCCCCCCCCCCCCCC1=C(C(=O)N(N1C)C)N.Cl

InChI

InChI=1S/C20H39N3O.ClH/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19(21)20(24)23(3)22(18)2;/h4-17,21H2,1-3H3;1H