[2-oxidanylidene-2-[(4-piperidin-1-ylphenyl)amino]ethyl] 1-ethylbenzotriazole-5-carboxylate

Systemtic Name: [2-oxidanylidene-2-[(4-piperidin-1-ylphenyl)amino]ethyl] 1-ethylbenzotriazole-5-carboxylate Openeye Name: [2-oxo-2-[4-(1-piperidyl)anilino]ethyl] 1-ethylbenzotriazole-5-carboxylate CAS Name: 1-ethyl-5-benzotriazolecarboxylic acid [2-oxo-2-[4-(1-piperidinyl)anilino]ethyl] ester IUPAC Name: [2-oxo-2-(4-piperidin-1-ylanilino)ethyl] 1-ethylbenzotriazole-5-carboxylate Traditional Name: 1-ethylbenzotriazole-5-carboxylic acid [2-keto-2-(4-piperidinoanilino)ethyl] ester Formula: C22H25N5O3 MolecularWeight: 407.4656

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)C(=O)OCC(=O)NC3=CC=C(C=C3)N4CCCCC4)N=N1

Isomeric SMILES

CCN1C2=C(C=C(C=C2)C(=O)OCC(=O)NC3=CC=C(C=C3)N4CCCCC4)N=N1

InChI

InChI=1S/C22H25N5O3/c1-2-27-20-11-6-16(14-19(20)24-25-27)22(29)30-15-21(28)23-17-7-9-18(10-8-17)26-12-4-3-5-13-26/h6-11,14H,2-5,12-13,15H2,1H3,(H,23,28)