[4-(2,3-dihydro-1,4-benzodioxin-6-yl)oxan-4-yl]methyl-(3,3-diphenylpropyl)azanium

Systemtic Name: [4-(2,3-dihydro-1,4-benzodioxin-6-yl)oxan-4-yl]methyl-(3,3-diphenylpropyl)azanium Openeye Name: [4-(2,3-dihydro-1,4-benzodioxin-6-yl)tetrahydropyran-4-yl]methyl-(3,3-diphenylpropyl)ammonium CAS Name: [4-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-oxanyl]methyl-(3,3-diphenylpropyl)ammonium IUPAC Name: [4-(2,3-dihydro-1,4-benzodioxin-6-yl)oxan-4-yl]methyl-(3,3-diphenylpropyl)azanium Traditional Name: [4-(2,3-dihydro-1,4-benzodioxin-6-yl)tetrahydropyran-4-yl]methyl-(3,3-diphenylpropyl)ammonium Formula: C29H34NO3+ MolecularWeight: 444.58516

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCC1(C[NH2+]CCC(C2=CC=CC=C2)C3=CC=CC=C3)C4=CC5=C(C=C4)OCCO5

Isomeric SMILES

C1COCCC1(C[NH2+]CCC(C2=CC=CC=C2)C3=CC=CC=C3)C4=CC5=C(C=C4)OCCO5

InChI

InChI=1S/C29H33NO3/c1-3-7-23(8-4-1)26(24-9-5-2-6-10-24)13-16-30-22-29(14-17-31-18-15-29)25-11-12-27-28(21-25)33-20-19-32-27/h1-12,21,26,30H,13-20,22H2/p+1