4-[[[1-[(2-methylphenoxy)methyl]pyrazol-3-yl]carbonylamino]methyl]benzoic acid

Systemtic Name: 4-[[[1-[(2-methylphenoxy)methyl]pyrazol-3-yl]carbonylamino]methyl]benzoic acid Openeye Name: 4-[[[1-[(2-methylphenoxy)methyl]pyrazole-3-carbonyl]amino]methyl]benzoic acid CAS Name: 4-[[[[1-[(2-methylphenoxy)methyl]-3-pyrazolyl]-oxomethyl]amino]methyl]benzoic acid IUPAC Name: 4-[[[1-[(2-methylphenoxy)methyl]pyrazole-3-carbonyl]amino]methyl]benzoic acid Traditional Name: 4-[[[1-[(2-methylphenoxy)methyl]pyrazole-3-carbonyl]amino]methyl]benzoic acid Formula: C20H19N3O4 MolecularWeight: 365.38256

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OCN2C=CC(=N2)C(=O)NCC3=CC=C(C=C3)C(=O)O

Isomeric SMILES

CC1=CC=CC=C1OCN2C=CC(=N2)C(=O)NCC3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C20H19N3O4/c1-14-4-2-3-5-18(14)27-13-23-11-10-17(22-23)19(24)21-12-15-6-8-16(9-7-15)20(25)26/h2-11H,12-13H2,1H3,(H,21,24)(H,25,26)