1-[4-(1-oxidanidylpyridin-1-ium-4-yl)carbonylpiperazin-1-yl]-3,3-diphenyl-propan-1-one

Systemtic Name: 1-[4-(1-oxidanidylpyridin-1-ium-4-yl)carbonylpiperazin-1-yl]-3,3-diphenyl-propan-1-one Openeye Name: 1-[4-(1-oxidopyridin-1-ium-4-carbonyl)piperazin-1-yl]-3,3-diphenyl-propan-1-one CAS Name: 1-[4-[(1-oxido-4-pyridin-1-iumyl)-oxomethyl]-1-piperazinyl]-3,3-diphenyl-1-propanone IUPAC Name: 1-[4-(1-oxidopyridin-1-ium-4-carbonyl)piperazin-1-yl]-3,3-diphenylpropan-1-one Traditional Name: 1-[4-(1-oxidopyridin-1-ium-4-carbonyl)piperazino]-3,3-diphenyl-propan-1-one Formula: C25H25N3O3 MolecularWeight: 415.4843

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CC(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)C4=CC=[N+](C=C4)[O-]

Isomeric SMILES

C1CN(CCN1C(=O)CC(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)C4=CC=[N+](C=C4)[O-]

InChI

InChI=1S/C25H25N3O3/c29-24(19-23(20-7-3-1-4-8-20)21-9-5-2-6-10-21)26-15-17-27(18-16-26)25(30)22-11-13-28(31)14-12-22/h1-14,23H,15-19H2