2-[3-[[1-[(2-methylphenyl)methyl]pyrazol-3-yl]amino]-3-oxidanylidene-propyl]pyrazole-3-carboxylic acid

Systemtic Name: 2-[3-[[1-[(2-methylphenyl)methyl]pyrazol-3-yl]amino]-3-oxidanylidene-propyl]pyrazole-3-carboxylic acid Openeye Name: 2-[3-[[1-(o-tolylmethyl)pyrazol-3-yl]amino]-3-oxo-propyl]pyrazole-3-carboxylic acid CAS Name: 2-[3-[[1-[(2-methylphenyl)methyl]-3-pyrazolyl]amino]-3-oxopropyl]-3-pyrazolecarboxylic acid IUPAC Name: 2-[3-[[1-[(2-methylphenyl)methyl]pyrazol-3-yl]amino]-3-oxopropyl]pyrazole-3-carboxylic acid Traditional Name: 2-[3-keto-3-[[1-(2-methylbenzyl)pyrazol-3-yl]amino]propyl]pyrazole-3-carboxylic acid Formula: C18H19N5O3 MolecularWeight: 353.37516

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN2C=CC(=N2)NC(=O)CCN3C(=CC=N3)C(=O)O

Isomeric SMILES

CC1=CC=CC=C1CN2C=CC(=N2)NC(=O)CCN3C(=CC=N3)C(=O)O

InChI

InChI=1S/C18H19N5O3/c1-13-4-2-3-5-14(13)12-22-10-7-16(21-22)20-17(24)8-11-23-15(18(25)26)6-9-19-23/h2-7,9-10H,8,11-12H2,1H3,(H,25,26)(H,20,21,24)