4-(2-oxidanylidene-1,3-benzoxazol-3-yl)-N-[[2-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]butanamide

Systemtic Name: 4-(2-oxidanylidene-1,3-benzoxazol-3-yl)-N-[[2-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]butanamide Openeye Name: 4-(2-oxo-1,3-benzoxazol-3-yl)-N-[[2-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]butanamide CAS Name: 4-(2-oxo-1,3-benzoxazol-3-yl)-N-[[2-(1-piperidin-1-iumylmethyl)phenyl]methyl]butanamide IUPAC Name: 4-(2-oxo-1,3-benzoxazol-3-yl)-N-[[2-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]butanamide Traditional Name: 4-(2-keto-1,3-benzoxazol-3-yl)-N-[2-(piperidin-1-ium-1-ylmethyl)benzyl]butyramide Formula: C24H30N3O3+ MolecularWeight: 408.5133

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CC2=CC=CC=C2CNC(=O)CCCN3C4=CC=CC=C4OC3=O

Isomeric SMILES

C1CC[NH+](CC1)CC2=CC=CC=C2CNC(=O)CCCN3C4=CC=CC=C4OC3=O

InChI

InChI=1S/C24H29N3O3/c28-23(13-8-16-27-21-11-4-5-12-22(21)30-24(27)29)25-17-19-9-2-3-10-20(19)18-26-14-6-1-7-15-26/h2-5,9-12H,1,6-8,13-18H2,(H,25,28)/p+1