4-[4-[2-(3-methylphenoxy)ethanoylamino]pyrazol-1-yl]butanoate

Systemtic Name: 4-[4-[2-(3-methylphenoxy)ethanoylamino]pyrazol-1-yl]butanoate Openeye Name: 4-[4-[[2-(3-methylphenoxy)acetyl]amino]pyrazol-1-yl]butanoate CAS Name: 4-[4-[[2-(3-methylphenoxy)-1-oxoethyl]amino]-1-pyrazolyl]butanoate IUPAC Name: 4-[4-[[2-(3-methylphenoxy)acetyl]amino]pyrazol-1-yl]butanoate Traditional Name: 4-[4-[[2-(3-methylphenoxy)acetyl]amino]pyrazol-1-yl]butyrate Formula: C16H18N3O4- MolecularWeight: 316.33182

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCC(=O)NC2=CN(N=C2)CCCC(=O)[O-]

Isomeric SMILES

CC1=CC(=CC=C1)OCC(=O)NC2=CN(N=C2)CCCC(=O)[O-]

InChI

InChI=1S/C16H19N3O4/c1-12-4-2-5-14(8-12)23-11-15(20)18-13-9-17-19(10-13)7-3-6-16(21)22/h2,4-5,8-10H,3,6-7,11H2,1H3,(H,18,20)(H,21,22)/p-1