1-adamantyl-[(1-pyridin-3-ylpyrrol-2-yl)methyl]azanium

Systemtic Name: 1-adamantyl-[(1-pyridin-3-ylpyrrol-2-yl)methyl]azanium Openeye Name: 1-adamantyl-[[1-(3-pyridyl)pyrrol-2-yl]methyl]ammonium CAS Name: 1-adamantyl-[[1-(3-pyridinyl)-2-pyrrolyl]methyl]ammonium IUPAC Name: 1-adamantyl-[(1-pyridin-3-ylpyrrol-2-yl)methyl]azanium Traditional Name: 1-adamantyl-[[1-(3-pyridyl)pyrrol-2-yl]methyl]ammonium Formula: C20H26N3+ MolecularWeight: 308.44054

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)[NH2+]CC4=CC=CN4C5=CN=CC=C5

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)[NH2+]CC4=CC=CN4C5=CN=CC=C5

InChI

InChI=1S/C20H25N3/c1-3-18(13-21-5-1)23-6-2-4-19(23)14-22-20-10-15-7-16(11-20)9-17(8-15)12-20/h1-6,13,15-17,22H,7-12,14H2/p+1