methyl 3-[2-oxidanylidene-2-[4-(phenylmethyl)piperidin-1-yl]ethoxy]benzotriazole-5-carboxylate

Systemtic Name: methyl 3-[2-oxidanylidene-2-[4-(phenylmethyl)piperidin-1-yl]ethoxy]benzotriazole-5-carboxylate Openeye Name: methyl 3-[2-(4-benzyl-1-piperidyl)-2-oxo-ethoxy]benzotriazole-5-carboxylate CAS Name: 3-[2-oxo-2-[4-(phenylmethyl)-1-piperidinyl]ethoxy]-5-benzotriazolecarboxylic acid methyl ester IUPAC Name: methyl 3-[2-(4-benzylpiperidin-1-yl)-2-oxoethoxy]benzotriazole-5-carboxylate Traditional Name: 3-[2-(4-benzylpiperidino)-2-keto-ethoxy]benzotriazole-5-carboxylic acid methyl ester Formula: C22H24N4O4 MolecularWeight: 408.45036

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)N=NN2OCC(=O)N3CCC(CC3)CC4=CC=CC=C4

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)N=NN2OCC(=O)N3CCC(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C22H24N4O4/c1-29-22(28)18-7-8-19-20(14-18)26(24-23-19)30-15-21(27)25-11-9-17(10-12-25)13-16-5-3-2-4-6-16/h2-8,14,17H,9-13,15H2,1H3