N-[1-[2-(cyclopropylamino)-2-oxidanylidene-ethyl]piperidin-1-ium-4-yl]-3-methyl-benzamide

Systemtic Name: N-[1-[2-(cyclopropylamino)-2-oxidanylidene-ethyl]piperidin-1-ium-4-yl]-3-methyl-benzamide Openeye Name: N-[1-[2-(cyclopropylamino)-2-oxo-ethyl]piperidin-1-ium-4-yl]-3-methyl-benzamide CAS Name: N-[1-[2-(cyclopropylamino)-2-oxoethyl]-4-piperidin-1-iumyl]-3-methylbenzamide IUPAC Name: N-[1-[2-(cyclopropylamino)-2-oxoethyl]piperidin-1-ium-4-yl]-3-methylbenzamide Traditional Name: N-[1-[2-(cyclopropylamino)-2-keto-ethyl]piperidin-1-ium-4-yl]-3-methyl-benzamide Formula: C18H26N3O2+ MolecularWeight: 316.41794

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)NC2CC[NH+](CC2)CC(=O)NC3CC3

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)NC2CC[NH+](CC2)CC(=O)NC3CC3

InChI

InChI=1S/C18H25N3O2/c1-13-3-2-4-14(11-13)18(23)20-16-7-9-21(10-8-16)12-17(22)19-15-5-6-15/h2-4,11,15-16H,5-10,12H2,1H3,(H,19,22)(H,20,23)/p+1