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

Systemtic Name: (3-oxidanidylbenzotriazol-3-ium-1-yl)-[4-(4-piperidin-1-ylpiperidin-1-yl)phenyl]methanone Openeye Name: (3-oxidobenzotriazol-3-ium-1-yl)-[4-[4-(1-piperidyl)-1-piperidyl]phenyl]methanone CAS Name: (3-oxido-1-benzotriazol-3-iumyl)-[4-[4-(1-piperidinyl)-1-piperidinyl]phenyl]methanone IUPAC Name: (3-oxidobenzotriazol-3-ium-1-yl)-[4-(4-piperidin-1-ylpiperidin-1-yl)phenyl]methanone Traditional Name: (3-oxidobenzotriazol-3-ium-1-yl)-[4-(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=C(C=C3)C(=O)N4C5=CC=CC=C5[N+](=N4)[O-]

Isomeric SMILES

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

InChI

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