(phenylmethyl) 2-(5-methyl-4-piperazin-1-ylcarbonyl-1,2,3-triazol-1-yl)ethanoate

Systemtic Name: (phenylmethyl) 2-(5-methyl-4-piperazin-1-ylcarbonyl-1,2,3-triazol-1-yl)ethanoate Openeye Name: benzyl 2-[5-methyl-4-(piperazine-1-carbonyl)triazol-1-yl]acetate CAS Name: 2-[5-methyl-4-[oxo(1-piperazinyl)methyl]-1-triazolyl]acetic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[5-methyl-4-(piperazine-1-carbonyl)triazol-1-yl]acetate Traditional Name: 2-[5-methyl-4-(piperazine-1-carbonyl)triazol-1-yl]acetic acid benzyl ester Formula: C17H21N5O3 MolecularWeight: 343.38034

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=NN1CC(=O)OCC2=CC=CC=C2)C(=O)N3CCNCC3

Isomeric SMILES

CC1=C(N=NN1CC(=O)OCC2=CC=CC=C2)C(=O)N3CCNCC3

InChI

InChI=1S/C17H21N5O3/c1-13-16(17(24)21-9-7-18-8-10-21)19-20-22(13)11-15(23)25-12-14-5-3-2-4-6-14/h2-6,18H,7-12H2,1H3