4-methoxy-N-[1-[2-oxidanylidene-2-[(phenylmethyl)amino]ethyl]piperidin-1-ium-4-yl]benzamide

Systemtic Name: 4-methoxy-N-[1-[2-oxidanylidene-2-[(phenylmethyl)amino]ethyl]piperidin-1-ium-4-yl]benzamide Openeye Name: N-[1-[2-(benzylamino)-2-oxo-ethyl]piperidin-1-ium-4-yl]-4-methoxy-benzamide CAS Name: 4-methoxy-N-[1-[2-oxo-2-[(phenylmethyl)amino]ethyl]-4-piperidin-1-iumyl]benzamide IUPAC Name: N-[1-[2-(benzylamino)-2-oxoethyl]piperidin-1-ium-4-yl]-4-methoxybenzamide Traditional Name: N-[1-[2-(benzylamino)-2-keto-ethyl]piperidin-1-ium-4-yl]-4-methoxy-benzamide Formula: C22H28N3O3+ MolecularWeight: 382.47602

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)NC2CC[NH+](CC2)CC(=O)NCC3=CC=CC=C3

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)NC2CC[NH+](CC2)CC(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C22H27N3O3/c1-28-20-9-7-18(8-10-20)22(27)24-19-11-13-25(14-12-19)16-21(26)23-15-17-5-3-2-4-6-17/h2-10,19H,11-16H2,1H3,(H,23,26)(H,24,27)/p+1