3-methyl-4-phenyl-1-propan-2-yl-spiro[3H-azet-1-ium-2,2'-adamantane]

Systemtic Name: 3-methyl-4-phenyl-1-propan-2-yl-spiro[3H-azet-1-ium-2,2'-adamantane] Openeye Name: 1-isopropyl-3-methyl-4-phenyl-spiro[3H-azet-1-ium-2,2'-adamantane] CAS Name: 3-methyl-4-phenyl-1-propan-2-ylspiro[3H-azet-1-ium-2,2'-adamantane] IUPAC Name: 3-methyl-4-phenyl-1-propan-2-ylspiro[3H-azet-1-ium-2,2'-adamantane] Traditional Name: 1-isopropyl-3-methyl-4-phenyl-spiro[3H-azet-1-ium-2,2'-adamantane] Formula: C22H30N+ MolecularWeight: 308.4803

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=[N+](C12C3CC4CC(C3)CC2C4)C(C)C)C5=CC=CC=C5

Isomeric SMILES

CC1C(=[N+](C12C3CC4CC(C3)CC2C4)C(C)C)C5=CC=CC=C5

InChI

InChI=1S/C22H30N/c1-14(2)23-21(18-7-5-4-6-8-18)15(3)22(23)19-10-16-9-17(12-19)13-20(22)11-16/h4-8,14-17,19-20H,9-13H2,1-3H3/q+1