(3-oxidanidylbenzotriazol-3-ium-1-yl)-[2-(4-piperidin-1-ylpiperidin-1-yl)phenyl]methanone

Systemtic Name: (3-oxidanidylbenzotriazol-3-ium-1-yl)-[2-(4-piperidin-1-ylpiperidin-1-yl)phenyl]methanone Openeye Name: (3-oxidobenzotriazol-3-ium-1-yl)-[2-[4-(1-piperidyl)-1-piperidyl]phenyl]methanone CAS Name: (3-oxido-1-benzotriazol-3-iumyl)-[2-[4-(1-piperidinyl)-1-piperidinyl]phenyl]methanone IUPAC Name: (3-oxidobenzotriazol-3-ium-1-yl)-[2-(4-piperidin-1-ylpiperidin-1-yl)phenyl]methanone Traditional Name: (3-oxidobenzotriazol-3-ium-1-yl)-[2-(4-piperidinopiperidino)phenyl]methanone Formula: C23H27N5O2 MolecularWeight: 405.49278

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2CCN(CC2)C3=CC=CC=C3C(=O)N4C5=CC=CC=C5[N+](=N4)[O-]

Isomeric SMILES

C1CCN(CC1)C2CCN(CC2)C3=CC=CC=C3C(=O)N4C5=CC=CC=C5[N+](=N4)[O-]

InChI

InChI=1S/C23H27N5O2/c29-23(27-21-10-4-5-11-22(21)28(30)24-27)19-8-2-3-9-20(19)26-16-12-18(13-17-26)25-14-6-1-7-15-25/h2-5,8-11,18H,1,6-7,12-17H2