[2-[4-(1,3-benzoxazol-2-yl)piperidin-1-yl]-2-oxidanylidene-ethyl]-(diphenylmethyl)azanium

Systemtic Name: [2-[4-(1,3-benzoxazol-2-yl)piperidin-1-yl]-2-oxidanylidene-ethyl]-(diphenylmethyl)azanium Openeye Name: benzhydryl-[2-[4-(1,3-benzoxazol-2-yl)-1-piperidyl]-2-oxo-ethyl]ammonium CAS Name: [2-[4-(1,3-benzoxazol-2-yl)-1-piperidinyl]-2-oxoethyl]-(diphenylmethyl)ammonium IUPAC Name: benzhydryl-[2-[4-(1,3-benzoxazol-2-yl)piperidin-1-yl]-2-oxoethyl]azanium Traditional Name: benzhydryl-[2-[4-(1,3-benzoxazol-2-yl)piperidino]-2-keto-ethyl]ammonium Formula: C27H28N3O2+ MolecularWeight: 426.53012

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2=NC3=CC=CC=C3O2)C(=O)C[NH2+]C(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCC1C2=NC3=CC=CC=C3O2)C(=O)C[NH2+]C(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C27H27N3O2/c31-25(19-28-26(20-9-3-1-4-10-20)21-11-5-2-6-12-21)30-17-15-22(16-18-30)27-29-23-13-7-8-14-24(23)32-27/h1-14,22,26,28H,15-19H2/p+1