4-(2-tert-butyl-6-methyl-azulen-1-yl)-2,6-dimethyl-1-phenyl-pyridin-1-ium

Systemtic Name: 4-(2-tert-butyl-6-methyl-azulen-1-yl)-2,6-dimethyl-1-phenyl-pyridin-1-ium Openeye Name: 4-(2-tert-butyl-6-methyl-azulen-1-yl)-2,6-dimethyl-1-phenyl-pyridin-1-ium CAS Name: 4-(2-tert-butyl-6-methyl-1-azulenyl)-2,6-dimethyl-1-phenylpyridin-1-ium IUPAC Name: 4-(2-tert-butyl-6-methylazulen-1-yl)-2,6-dimethyl-1-phenylpyridin-1-ium Traditional Name: 4-(2-tert-butyl-6-methyl-azulen-1-yl)-2,6-dimethyl-1-phenyl-pyridin-1-ium Formula: C28H30N+ MolecularWeight: 380.5445

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C2C(=CC(=C2C3=CC(=[N+](C(=C3)C)C4=CC=CC=C4)C)C(C)(C)C)C=C1

Isomeric SMILES

CC1=CC=C2C(=CC(=C2C3=CC(=[N+](C(=C3)C)C4=CC=CC=C4)C)C(C)(C)C)C=C1

InChI

InChI=1S/C28H30N/c1-19-12-14-22-18-26(28(4,5)6)27(25(22)15-13-19)23-16-20(2)29(21(3)17-23)24-10-8-7-9-11-24/h7-18H,1-6H3/q+1