2-[4-(2,3-dihydro-1,4-benzodioxin-5-yl)pyridin-1-ium-1-yl]-6-methyl-2,3-dihydroinden-1-one

Systemtic Name: 2-[4-(2,3-dihydro-1,4-benzodioxin-5-yl)pyridin-1-ium-1-yl]-6-methyl-2,3-dihydroinden-1-one Openeye Name: 2-[4-(2,3-dihydro-1,4-benzodioxin-5-yl)pyridin-1-ium-1-yl]-6-methyl-indan-1-one CAS Name: 2-[4-(2,3-dihydro-1,4-benzodioxin-5-yl)-1-pyridin-1-iumyl]-6-methyl-2,3-dihydroinden-1-one IUPAC Name: 2-[4-(2,3-dihydro-1,4-benzodioxin-5-yl)pyridin-1-ium-1-yl]-6-methyl-2,3-dihydroinden-1-one Traditional Name: 2-[4-(2,3-dihydro-1,4-benzodioxin-5-yl)pyridin-1-ium-1-yl]-6-methyl-indan-1-one Formula: C23H20NO3+ MolecularWeight: 358.4098

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(CC(C2=O)[N+]3=CC=C(C=C3)C4=C5C(=CC=C4)OCCO5)C=C1

Isomeric SMILES

CC1=CC2=C(CC(C2=O)[N+]3=CC=C(C=C3)C4=C5C(=CC=C4)OCCO5)C=C1

InChI

InChI=1S/C23H20NO3/c1-15-5-6-17-14-20(22(25)19(17)13-15)24-9-7-16(8-10-24)18-3-2-4-21-23(18)27-12-11-26-21/h2-10,13,20H,11-12,14H2,1H3/q+1