4-[(Z)-3-methyl-1-(6-methylchromenylium-2-yl)but-1-en-2-yl]benzoic acid perchlorate

Systemtic Name: 4-[(Z)-3-methyl-1-(6-methylchromenylium-2-yl)but-1-en-2-yl]benzoic acid perchlorate Openeye Name: 4-[(1Z)-2-methyl-1-[(6-methylchromenylium-2-yl)methylene]propyl]benzoic acid perchlorate CAS Name: 4-[(Z)-3-methyl-1-(6-methyl-1-benzopyrylium-2-yl)but-1-en-2-yl]benzoic acid perchlorate IUPAC Name: 4-[(Z)-3-methyl-1-(6-methylchromenylium-2-yl)but-1-en-2-yl]benzoic acid perchlorate Traditional Name: 4-[(Z)-1-isopropyl-2-(6-methyl-1-benzopyrylium-2-yl)vinyl]benzoic acid perchlorate Formula: C22H21ClO7 MolecularWeight: 432.85094

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)[O+]=C(C=C2)C=C(C3=CC=C(C=C3)C(=O)O)C(C)C.[O-]Cl(=O)(=O)=O

Isomeric SMILES

CC1=CC2=C(C=C1)[O+]=C(C=C2)/C=C(\C3=CC=C(C=C3)C(=O)O)/C(C)C.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C22H20O3.ClHO4/c1-14(2)20(16-5-7-17(8-6-16)22(23)24)13-19-10-9-18-12-15(3)4-11-21(18)25-19;2-1(3,4)5/h4-14H,1-3H3;(H,2,3,4,5)/b20-13-;