methyl 2-[(3,5-dimethyl-1H-pyrazol-4-yl)methylamino]-3-methyl-pentanoate

Systemtic Name: methyl 2-[(3,5-dimethyl-1H-pyrazol-4-yl)methylamino]-3-methyl-pentanoate Openeye Name: methyl 2-[(3,5-dimethyl-1H-pyrazol-4-yl)methylamino]-3-methyl-pentanoate CAS Name: 2-[(3,5-dimethyl-1H-pyrazol-4-yl)methylamino]-3-methylpentanoic acid methyl ester IUPAC Name: methyl 2-[(3,5-dimethyl-1H-pyrazol-4-yl)methylamino]-3-methylpentanoate Traditional Name: 2-[(3,5-dimethyl-1H-pyrazol-4-yl)methylamino]-3-methyl-valeric acid methyl ester Formula: C13H23N3O2 MolecularWeight: 253.34062

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)OC)NCC1=C(NN=C1C)C

Isomeric SMILES

CCC(C)C(C(=O)OC)NCC1=C(NN=C1C)C

InChI

InChI=1S/C13H23N3O2/c1-6-8(2)12(13(17)18-5)14-7-11-9(3)15-16-10(11)4/h8,12,14H,6-7H2,1-5H3,(H,15,16)