2-azanyl-4-(1-methylpyrrol-2-yl)-5,6,7,8,9,10-hexahydrocycloocta[b]pyridin-1-ium-3-carbonitrile

Systemtic Name: 2-azanyl-4-(1-methylpyrrol-2-yl)-5,6,7,8,9,10-hexahydrocycloocta[b]pyridin-1-ium-3-carbonitrile Openeye Name: 2-amino-4-(1-methylpyrrol-2-yl)-5,6,7,8,9,10-hexahydrocycloocta[b]pyridin-1-ium-3-carbonitrile CAS Name: 2-amino-4-(1-methyl-2-pyrrolyl)-5,6,7,8,9,10-hexahydrocycloocta[b]pyridin-1-ium-3-carbonitrile IUPAC Name: 2-amino-4-(1-methylpyrrol-2-yl)-5,6,7,8,9,10-hexahydrocycloocta[b]pyridin-1-ium-3-carbonitrile Traditional Name: 2-amino-4-(1-methylpyrrol-2-yl)-5,6,7,8,9,10-hexahydrocycloocta[b]pyridin-1-ium-3-carbonitrile Formula: C17H21N4+ MolecularWeight: 281.37544

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC=C1C2=C(C(=[NH+]C3=C2CCCCCC3)N)C#N

Isomeric SMILES

CN1C=CC=C1C2=C(C(=[NH+]C3=C2CCCCCC3)N)C#N

InChI

InChI=1S/C17H20N4/c1-21-10-6-9-15(21)16-12-7-4-2-3-5-8-14(12)20-17(19)13(16)11-18/h6,9-10H,2-5,7-8H2,1H3,(H2,19,20)/p+1