[2-(cyclopropylamino)-2-oxidanylidene-ethyl]-[1-(phenylmethyl)piperidin-1-ium-4-yl]azanium

Systemtic Name: [2-(cyclopropylamino)-2-oxidanylidene-ethyl]-[1-(phenylmethyl)piperidin-1-ium-4-yl]azanium Openeye Name: (1-benzylpiperidin-1-ium-4-yl)-[2-(cyclopropylamino)-2-oxo-ethyl]ammonium CAS Name: [2-(cyclopropylamino)-2-oxoethyl]-[1-(phenylmethyl)-4-piperidin-1-iumyl]ammonium IUPAC Name: (1-benzylpiperidin-1-ium-4-yl)-[2-(cyclopropylamino)-2-oxoethyl]azanium Traditional Name: (1-benzylpiperidin-1-ium-4-yl)-[2-(cyclopropylamino)-2-keto-ethyl]ammonium Formula: C17H27N3O+2 MolecularWeight: 289.41578

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)C[NH2+]C2CC[NH+](CC2)CC3=CC=CC=C3

Isomeric SMILES

C1CC1NC(=O)C[NH2+]C2CC[NH+](CC2)CC3=CC=CC=C3

InChI

InChI=1S/C17H25N3O/c21-17(19-16-6-7-16)12-18-15-8-10-20(11-9-15)13-14-4-2-1-3-5-14/h1-5,15-16,18H,6-13H2,(H,19,21)/p+2