methyl-[2-oxidanylidene-2-[(4-piperidin-1-ylphenyl)amino]ethyl]-(phenylmethyl)azanium

Systemtic Name: methyl-[2-oxidanylidene-2-[(4-piperidin-1-ylphenyl)amino]ethyl]-(phenylmethyl)azanium Openeye Name: benzyl-methyl-[2-oxo-2-[4-(1-piperidyl)anilino]ethyl]ammonium CAS Name: methyl-[2-oxo-2-[4-(1-piperidinyl)anilino]ethyl]-(phenylmethyl)ammonium IUPAC Name: benzyl-methyl-[2-oxo-2-(4-piperidin-1-ylanilino)ethyl]azanium Traditional Name: benzyl-[2-keto-2-(4-piperidinoanilino)ethyl]-methyl-ammonium Formula: C21H28N3O+ MolecularWeight: 338.46652

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=CC=C1)CC(=O)NC2=CC=C(C=C2)N3CCCCC3

Isomeric SMILES

C[NH+](CC1=CC=CC=C1)CC(=O)NC2=CC=C(C=C2)N3CCCCC3

InChI

InChI=1S/C21H27N3O/c1-23(16-18-8-4-2-5-9-18)17-21(25)22-19-10-12-20(13-11-19)24-14-6-3-7-15-24/h2,4-5,8-13H,3,6-7,14-17H2,1H3,(H,22,25)/p+1