2-[2-(7-chloranyl-6-methyl-5H-pyrazolo[5,1-c][1,2,4]triazol-3-yl)ethylcarbamoyl]benzoic acid

Systemtic Name: 2-[2-(7-chloranyl-6-methyl-5H-pyrazolo[5,1-c][1,2,4]triazol-3-yl)ethylcarbamoyl]benzoic acid Openeye Name: 2-[2-(7-chloro-6-methyl-5H-pyrazolo[5,1-c][1,2,4]triazol-3-yl)ethylcarbamoyl]benzoic acid CAS Name: 2-[[2-(7-chloro-6-methyl-5H-pyrazolo[5,1-c][1,2,4]triazol-3-yl)ethylamino]-oxomethyl]benzoic acid IUPAC Name: 2-[2-(7-chloro-6-methyl-5H-pyrazolo[5,1-c][1,2,4]triazol-3-yl)ethylcarbamoyl]benzoic acid Traditional Name: 2-[2-(7-chloro-6-methyl-5H-pyrazolo[5,1-c][1,2,4]triazol-3-yl)ethylcarbamoyl]benzoic acid Formula: C15H14ClN5O3 MolecularWeight: 347.75636

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=NN=C(N2N1)CCNC(=O)C3=CC=CC=C3C(=O)O)Cl

Isomeric SMILES

CC1=C(C2=NN=C(N2N1)CCNC(=O)C3=CC=CC=C3C(=O)O)Cl

InChI

InChI=1S/C15H14ClN5O3/c1-8-12(16)13-19-18-11(21(13)20-8)6-7-17-14(22)9-4-2-3-5-10(9)15(23)24/h2-5,20H,6-7H2,1H3,(H,17,22)(H,23,24)