[2-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-oxidanylidene-ethyl]-phenyl-piperidin-2-ylidene-azanium

Systemtic Name: [2-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-oxidanylidene-ethyl]-phenyl-piperidin-2-ylidene-azanium Openeye Name: [2-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-oxo-ethyl]-phenyl-(2-piperidylidene)ammonium CAS Name: [2-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-oxoethyl]-phenyl-(2-piperidinylidene)ammonium IUPAC Name: [2-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-oxoethyl]-phenyl-piperidin-2-ylideneazanium Traditional Name: [2-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-keto-ethyl]-phenyl-(2-piperidylidene)ammonium Formula: C21H23N2O3+ MolecularWeight: 351.41892

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Descriptors Computed from Structure

Canonical SMILES:

C1CCNC(=[N+](CC(=O)C2=CC3=C(C=C2)OCCO3)C4=CC=CC=C4)C1

Isomeric SMILES

C1CCNC(=[N+](CC(=O)C2=CC3=C(C=C2)OCCO3)C4=CC=CC=C4)C1

InChI

InChI=1S/C21H22N2O3/c24-18(16-9-10-19-20(14-16)26-13-12-25-19)15-23(17-6-2-1-3-7-17)21-8-4-5-11-22-21/h1-3,6-7,9-10,14H,4-5,8,11-13,15H2/p+1