[4-oxidanylidene-4-[[1-(phenylmethyl)piperidin-1-ium-4-yl]amino]butyl]azanium

Systemtic Name: [4-oxidanylidene-4-[[1-(phenylmethyl)piperidin-1-ium-4-yl]amino]butyl]azanium Openeye Name: [4-[(1-benzylpiperidin-1-ium-4-yl)amino]-4-oxo-butyl]ammonium CAS Name: [4-oxo-4-[[1-(phenylmethyl)-4-piperidin-1-iumyl]amino]butyl]ammonium IUPAC Name: [4-[(1-benzylpiperidin-1-ium-4-yl)amino]-4-oxobutyl]azanium Traditional Name: [4-[(1-benzylpiperidin-1-ium-4-yl)amino]-4-keto-butyl]ammonium Formula: C16H27N3O+2 MolecularWeight: 277.40508

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1NC(=O)CCC[NH3+])CC2=CC=CC=C2

Isomeric SMILES

C1C[NH+](CCC1NC(=O)CCC[NH3+])CC2=CC=CC=C2

InChI

InChI=1S/C16H25N3O/c17-10-4-7-16(20)18-15-8-11-19(12-9-15)13-14-5-2-1-3-6-14/h1-3,5-6,15H,4,7-13,17H2,(H,18,20)/p+2