N-[1-(2-azanyl-2-oxidanylidene-ethyl)piperidin-1-ium-4-yl]-4-phenylmethoxy-benzamide

Systemtic Name: N-[1-(2-azanyl-2-oxidanylidene-ethyl)piperidin-1-ium-4-yl]-4-phenylmethoxy-benzamide Openeye Name: N-[1-(2-amino-2-oxo-ethyl)piperidin-1-ium-4-yl]-4-benzyloxy-benzamide CAS Name: N-[1-(2-amino-2-oxoethyl)-4-piperidin-1-iumyl]-4-phenylmethoxybenzamide IUPAC Name: N-[1-(2-amino-2-oxoethyl)piperidin-1-ium-4-yl]-4-phenylmethoxybenzamide Traditional Name: N-[1-(2-amino-2-keto-ethyl)piperidin-1-ium-4-yl]-4-benzoxy-benzamide Formula: C21H26N3O3+ MolecularWeight: 368.44944

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1NC(=O)C2=CC=C(C=C2)OCC3=CC=CC=C3)CC(=O)N

Isomeric SMILES

C1C[NH+](CCC1NC(=O)C2=CC=C(C=C2)OCC3=CC=CC=C3)CC(=O)N

InChI

InChI=1S/C21H25N3O3/c22-20(25)14-24-12-10-18(11-13-24)23-21(26)17-6-8-19(9-7-17)27-15-16-4-2-1-3-5-16/h1-9,18H,10-15H2,(H2,22,25)(H,23,26)/p+1