4-methyl-N-[2-oxidanylidene-2-[[4-(piperidin-1-ium-1-ylmethyl)phenyl]methylamino]ethyl]benzamide

Systemtic Name: 4-methyl-N-[2-oxidanylidene-2-[[4-(piperidin-1-ium-1-ylmethyl)phenyl]methylamino]ethyl]benzamide Openeye Name: 4-methyl-N-[2-oxo-2-[[4-(piperidin-1-ium-1-ylmethyl)phenyl]methylamino]ethyl]benzamide CAS Name: 4-methyl-N-[2-oxo-2-[[4-(1-piperidin-1-iumylmethyl)phenyl]methylamino]ethyl]benzamide IUPAC Name: 4-methyl-N-[2-oxo-2-[[4-(piperidin-1-ium-1-ylmethyl)phenyl]methylamino]ethyl]benzamide Traditional Name: N-[2-keto-2-[[4-(piperidin-1-ium-1-ylmethyl)benzyl]amino]ethyl]-4-methyl-benzamide Formula: C23H30N3O2+ MolecularWeight: 380.5032

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H29N3O2/c1-18-5-11-21(12-6-18)23(28)25-16-22(27)24-15-19-7-9-20(10-8-19)17-26-13-3-2-4-14-26/h5-12H,2-4,13-17H2,1H3,(H,24,27)(H,25,28)/p+1