[2-(azepan-1-yl)-2-oxidanylidene-ethyl]-(4-cyanophenyl)azanium

Systemtic Name: [2-(azepan-1-yl)-2-oxidanylidene-ethyl]-(4-cyanophenyl)azanium Openeye Name: [2-(azepan-1-yl)-2-oxo-ethyl]-(4-cyanophenyl)ammonium CAS Name: [2-(1-azepanyl)-2-oxoethyl]-(4-cyanophenyl)ammonium IUPAC Name: [2-(azepan-1-yl)-2-oxoethyl]-(4-cyanophenyl)azanium Traditional Name: [2-(azepan-1-yl)-2-keto-ethyl]-(4-cyanophenyl)ammonium Formula: C15H20N3O+ MolecularWeight: 258.3388

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)C[NH2+]C2=CC=C(C=C2)C#N

Isomeric SMILES

C1CCCN(CC1)C(=O)C[NH2+]C2=CC=C(C=C2)C#N

InChI

InChI=1S/C15H19N3O/c16-11-13-5-7-14(8-6-13)17-12-15(19)18-9-3-1-2-4-10-18/h5-8,17H,1-4,9-10,12H2/p+1