5-[[1-[(2-methylphenyl)methyl]pyrazol-3-yl]amino]-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-[[1-[(2-methylphenyl)methyl]pyrazol-3-yl]amino]-5-oxidanylidene-pentanoic acid Openeye Name: 5-[[1-(o-tolylmethyl)pyrazol-3-yl]amino]-5-oxo-pentanoic acid CAS Name: 5-[[1-[(2-methylphenyl)methyl]-3-pyrazolyl]amino]-5-oxopentanoic acid IUPAC Name: 5-[[1-[(2-methylphenyl)methyl]pyrazol-3-yl]amino]-5-oxopentanoic acid Traditional Name: 5-keto-5-[[1-(2-methylbenzyl)pyrazol-3-yl]amino]valeric acid Formula: C16H19N3O3 MolecularWeight: 301.34036

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN2C=CC(=N2)NC(=O)CCCC(=O)O

Isomeric SMILES

CC1=CC=CC=C1CN2C=CC(=N2)NC(=O)CCCC(=O)O

InChI

InChI=1S/C16H19N3O3/c1-12-5-2-3-6-13(12)11-19-10-9-14(18-19)17-15(20)7-4-8-16(21)22/h2-3,5-6,9-10H,4,7-8,11H2,1H3,(H,21,22)(H,17,18,20)