1-methyl-1-[2-methyl-1-(1-methyl-7-propan-2-yl-azulen-4-yl)propan-2-yl]pyrrolidin-1-ium iodide

Systemtic Name: 1-methyl-1-[2-methyl-1-(1-methyl-7-propan-2-yl-azulen-4-yl)propan-2-yl]pyrrolidin-1-ium iodide Openeye Name: 1-[2-(7-isopropyl-1-methyl-azulen-4-yl)-1,1-dimethyl-ethyl]-1-methyl-pyrrolidin-1-ium iodide CAS Name: 1-methyl-1-[2-methyl-1-(1-methyl-7-propan-2-yl-4-azulenyl)propan-2-yl]pyrrolidin-1-ium iodide IUPAC Name: 1-methyl-1-[2-methyl-1-(1-methyl-7-propan-2-ylazulen-4-yl)propan-2-yl]pyrrolidin-1-ium iodide Traditional Name: 1-[2-(7-isopropyl-1-methyl-azulen-4-yl)-1,1-dimethyl-ethyl]-1-methyl-pyrrolidin-1-ium iodide Formula: C23H34IN MolecularWeight: 451.42723

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C=C(C=CC(=C2C=C1)CC(C)(C)[N+]3(CCCC3)C)C(C)C.[I-]

Isomeric SMILES

CC1=C2C=C(C=CC(=C2C=C1)CC(C)(C)[N+]3(CCCC3)C)C(C)C.[I-]

InChI

InChI=1S/C23H34N.HI/c1-17(2)19-10-11-20(21-12-9-18(3)22(21)15-19)16-23(4,5)24(6)13-7-8-14-24;/h9-12,15,17H,7-8,13-14,16H2,1-6H3;1H/q+1;/p-1