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

Systemtic Name: 2-azanyl-4-(4-methoxy-2-methyl-phenyl)-5,6,7,8,9,10-hexahydrocycloocta[b]pyridin-1-ium-3-carbonitrile Openeye Name: 2-amino-4-(4-methoxy-2-methyl-phenyl)-5,6,7,8,9,10-hexahydrocycloocta[b]pyridin-1-ium-3-carbonitrile CAS Name: 2-amino-4-(4-methoxy-2-methylphenyl)-5,6,7,8,9,10-hexahydrocycloocta[b]pyridin-1-ium-3-carbonitrile IUPAC Name: 2-amino-4-(4-methoxy-2-methylphenyl)-5,6,7,8,9,10-hexahydrocycloocta[b]pyridin-1-ium-3-carbonitrile Traditional Name: 2-amino-4-(4-methoxy-2-methyl-phenyl)-5,6,7,8,9,10-hexahydrocycloocta[b]pyridin-1-ium-3-carbonitrile Formula: C20H24N3O+ MolecularWeight: 322.42406

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OC)C2=C(C(=[NH+]C3=C2CCCCCC3)N)C#N

Isomeric SMILES

CC1=C(C=CC(=C1)OC)C2=C(C(=[NH+]C3=C2CCCCCC3)N)C#N

InChI

InChI=1S/C20H23N3O/c1-13-11-14(24-2)9-10-15(13)19-16-7-5-3-4-6-8-18(16)23-20(22)17(19)12-21/h9-11H,3-8H2,1-2H3,(H2,22,23)/p+1