N-(2-ethylphenyl)-1-(1-methylbenzotriazol-5-yl)carbonyl-piperidine-4-carboxamide

Systemtic Name: N-(2-ethylphenyl)-1-(1-methylbenzotriazol-5-yl)carbonyl-piperidine-4-carboxamide Openeye Name: N-(2-ethylphenyl)-1-(1-methylbenzotriazole-5-carbonyl)piperidine-4-carboxamide CAS Name: N-(2-ethylphenyl)-1-[(1-methyl-5-benzotriazolyl)-oxomethyl]-4-piperidinecarboxamide IUPAC Name: N-(2-ethylphenyl)-1-(1-methylbenzotriazole-5-carbonyl)piperidine-4-carboxamide Traditional Name: N-(2-ethylphenyl)-1-(1-methylbenzotriazole-5-carbonyl)isonipecotamide Formula: C22H25N5O2 MolecularWeight: 391.4662

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=O)C2CCN(CC2)C(=O)C3=CC4=C(C=C3)N(N=N4)C

Isomeric SMILES

CCC1=CC=CC=C1NC(=O)C2CCN(CC2)C(=O)C3=CC4=C(C=C3)N(N=N4)C

InChI

InChI=1S/C22H25N5O2/c1-3-15-6-4-5-7-18(15)23-21(28)16-10-12-27(13-11-16)22(29)17-8-9-20-19(14-17)24-25-26(20)2/h4-9,14,16H,3,10-13H2,1-2H3,(H,23,28)