3-[3-[butyl(methyl)carbamoyl]pyrazol-1-yl]propanoate

Systemtic Name: 3-[3-[butyl(methyl)carbamoyl]pyrazol-1-yl]propanoate Openeye Name: 3-[3-[butyl(methyl)carbamoyl]pyrazol-1-yl]propanoate CAS Name: 3-[3-[[butyl(methyl)amino]-oxomethyl]-1-pyrazolyl]propanoate IUPAC Name: 3-[3-[butyl(methyl)carbamoyl]pyrazol-1-yl]propanoate Traditional Name: 3-[3-[butyl(methyl)carbamoyl]pyrazol-1-yl]propionate Formula: C12H18N3O3- MolecularWeight: 252.28962

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C)C(=O)C1=NN(C=C1)CCC(=O)[O-]

Isomeric SMILES

CCCCN(C)C(=O)C1=NN(C=C1)CCC(=O)[O-]

InChI

InChI=1S/C12H19N3O3/c1-3-4-7-14(2)12(18)10-5-8-15(13-10)9-6-11(16)17/h5,8H,3-4,6-7,9H2,1-2H3,(H,16,17)/p-1