1-(1,2-benzoxazol-3-yl)-1-(phenylmethyl)piperidin-1-ium-4-one

Systemtic Name: 1-(1,2-benzoxazol-3-yl)-1-(phenylmethyl)piperidin-1-ium-4-one Openeye Name: 1-(1,2-benzoxazol-3-yl)-1-benzyl-piperidin-1-ium-4-one CAS Name: 1-(1,2-benzoxazol-3-yl)-1-(phenylmethyl)-4-piperidin-1-iumone IUPAC Name: 1-(1,2-benzoxazol-3-yl)-1-benzylpiperidin-1-ium-4-one Traditional Name: 1-benzyl-1-indoxazen-3-yl-piperidin-1-ium-4-one Formula: C19H19N2O2+ MolecularWeight: 307.36636

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Descriptors Computed from Structure

Canonical SMILES:

C1C[N+](CCC1=O)(CC2=CC=CC=C2)C3=NOC4=CC=CC=C43

Isomeric SMILES

C1C[N+](CCC1=O)(CC2=CC=CC=C2)C3=NOC4=CC=CC=C43

InChI

InChI=1S/C19H19N2O2/c22-16-10-12-21(13-11-16,14-15-6-2-1-3-7-15)19-17-8-4-5-9-18(17)23-20-19/h1-9H,10-14H2/q+1