2-[4-(3-methoxy-4-propoxy-phenyl)carbonylpiperazin-1-ium-1-yl]-N-(phenylmethyl)ethanamide

Systemtic Name: 2-[4-(3-methoxy-4-propoxy-phenyl)carbonylpiperazin-1-ium-1-yl]-N-(phenylmethyl)ethanamide Openeye Name: N-benzyl-2-[4-(3-methoxy-4-propoxy-benzoyl)piperazin-1-ium-1-yl]acetamide CAS Name: 2-[4-[(3-methoxy-4-propoxyphenyl)-oxomethyl]-1-piperazin-1-iumyl]-N-(phenylmethyl)acetamide IUPAC Name: N-benzyl-2-[4-(3-methoxy-4-propoxybenzoyl)piperazin-1-ium-1-yl]acetamide Traditional Name: N-benzyl-2-[4-(3-methoxy-4-propoxy-benzoyl)piperazin-1-ium-1-yl]acetamide Formula: C24H32N3O4+ MolecularWeight: 426.52858

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)C(=O)N2CC[NH+](CC2)CC(=O)NCC3=CC=CC=C3)OC

Isomeric SMILES

CCCOC1=C(C=C(C=C1)C(=O)N2CC[NH+](CC2)CC(=O)NCC3=CC=CC=C3)OC

InChI

InChI=1S/C24H31N3O4/c1-3-15-31-21-10-9-20(16-22(21)30-2)24(29)27-13-11-26(12-14-27)18-23(28)25-17-19-7-5-4-6-8-19/h4-10,16H,3,11-15,17-18H2,1-2H3,(H,25,28)/p+1