3-methyl-N-[3-oxidanylidene-3-[[4-(piperidin-1-ium-1-ylmethyl)phenyl]methylamino]propyl]benzamide

Systemtic Name: 3-methyl-N-[3-oxidanylidene-3-[[4-(piperidin-1-ium-1-ylmethyl)phenyl]methylamino]propyl]benzamide Openeye Name: 3-methyl-N-[3-oxo-3-[[4-(piperidin-1-ium-1-ylmethyl)phenyl]methylamino]propyl]benzamide CAS Name: 3-methyl-N-[3-oxo-3-[[4-(1-piperidin-1-iumylmethyl)phenyl]methylamino]propyl]benzamide IUPAC Name: 3-methyl-N-[3-oxo-3-[[4-(piperidin-1-ium-1-ylmethyl)phenyl]methylamino]propyl]benzamide Traditional Name: N-[3-keto-3-[[4-(piperidin-1-ium-1-ylmethyl)benzyl]amino]propyl]-3-methyl-benzamide Formula: C24H32N3O2+ MolecularWeight: 394.52978

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)NCCC(=O)NCC2=CC=C(C=C2)C[NH+]3CCCCC3

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)NCCC(=O)NCC2=CC=C(C=C2)C[NH+]3CCCCC3

InChI

InChI=1S/C24H31N3O2/c1-19-6-5-7-22(16-19)24(29)25-13-12-23(28)26-17-20-8-10-21(11-9-20)18-27-14-3-2-4-15-27/h5-11,16H,2-4,12-15,17-18H2,1H3,(H,25,29)(H,26,28)/p+1