1-[4-[4-(benzotriazol-1-ylmethyl)phenyl]carbonylpiperazin-1-yl]-2-cyclopentyl-ethanone

Systemtic Name: 1-[4-[4-(benzotriazol-1-ylmethyl)phenyl]carbonylpiperazin-1-yl]-2-cyclopentyl-ethanone Openeye Name: 1-[4-[4-(benzotriazol-1-ylmethyl)benzoyl]piperazin-1-yl]-2-cyclopentyl-ethanone CAS Name: 1-[4-[[4-(1-benzotriazolylmethyl)phenyl]-oxomethyl]-1-piperazinyl]-2-cyclopentylethanone IUPAC Name: 1-[4-[4-(benzotriazol-1-ylmethyl)benzoyl]piperazin-1-yl]-2-cyclopentylethanone Traditional Name: 1-[4-[4-(benzotriazol-1-ylmethyl)benzoyl]piperazino]-2-cyclopentyl-ethanone Formula: C25H29N5O2 MolecularWeight: 431.53006

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)CC(=O)N2CCN(CC2)C(=O)C3=CC=C(C=C3)CN4C5=CC=CC=C5N=N4

Isomeric SMILES

C1CCC(C1)CC(=O)N2CCN(CC2)C(=O)C3=CC=C(C=C3)CN4C5=CC=CC=C5N=N4

InChI

InChI=1S/C25H29N5O2/c31-24(17-19-5-1-2-6-19)28-13-15-29(16-14-28)25(32)21-11-9-20(10-12-21)18-30-23-8-4-3-7-22(23)26-27-30/h3-4,7-12,19H,1-2,5-6,13-18H2