2-(3,8-dimethyl-5-propan-2-yl-azulen-1-yl)-4,6-dimethyl-pyrylium perchlorate

Systemtic Name: 2-(3,8-dimethyl-5-propan-2-yl-azulen-1-yl)-4,6-dimethyl-pyrylium perchlorate Openeye Name: 2-(5-isopropyl-3,8-dimethyl-azulen-1-yl)-4,6-dimethyl-pyrylium perchlorate CAS Name: 2-(3,8-dimethyl-5-propan-2-yl-1-azulenyl)-4,6-dimethylpyrylium perchlorate IUPAC Name: 2-(3,8-dimethyl-5-propan-2-ylazulen-1-yl)-4,6-dimethylpyrylium perchlorate Traditional Name: 2-(5-isopropyl-3,8-dimethyl-azulen-1-yl)-4,6-dimethyl-pyrylium perchlorate Formula: C22H25ClO5 MolecularWeight: 404.8839

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC(=C2C=C(C=C1)C(C)C)C)C3=[O+]C(=CC(=C3)C)C.[O-]Cl(=O)(=O)=O

Isomeric SMILES

CC1=C2C(=CC(=C2C=C(C=C1)C(C)C)C)C3=[O+]C(=CC(=C3)C)C.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C22H25O.ClHO4/c1-13(2)18-8-7-15(4)22-19(12-18)16(5)11-20(22)21-10-14(3)9-17(6)23-21;2-1(3,4)5/h7-13H,1-6H3;(H,2,3,4,5)/q+1;/p-1