N-(2-azanyl-2-oxidanylidene-ethyl)-4-(1-phenethylpiperidin-1-ium-4-yl)oxy-benzamide

Systemtic Name: N-(2-azanyl-2-oxidanylidene-ethyl)-4-(1-phenethylpiperidin-1-ium-4-yl)oxy-benzamide Openeye Name: N-(2-amino-2-oxo-ethyl)-4-(1-phenethylpiperidin-1-ium-4-yl)oxy-benzamide CAS Name: N-(2-amino-2-oxoethyl)-4-[(1-phenethyl-4-piperidin-1-iumyl)oxy]benzamide IUPAC Name: N-(2-amino-2-oxoethyl)-4-(1-phenethylpiperidin-1-ium-4-yl)oxybenzamide Traditional Name: N-(2-amino-2-keto-ethyl)-4-(1-phenethylpiperidin-1-ium-4-yl)oxy-benzamide Formula: C22H28N3O3+ MolecularWeight: 382.47602

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1OC2=CC=C(C=C2)C(=O)NCC(=O)N)CCC3=CC=CC=C3

Isomeric SMILES

C1C[NH+](CCC1OC2=CC=C(C=C2)C(=O)NCC(=O)N)CCC3=CC=CC=C3

InChI

InChI=1S/C22H27N3O3/c23-21(26)16-24-22(27)18-6-8-19(9-7-18)28-20-11-14-25(15-12-20)13-10-17-4-2-1-3-5-17/h1-9,20H,10-16H2,(H2,23,26)(H,24,27)/p+1