N,N-diethyl-2-[4-(1-oxidanylnaphthalen-2-yl)carbonylpiperazin-1-ium-1-yl]ethanamide

Systemtic Name: N,N-diethyl-2-[4-(1-oxidanylnaphthalen-2-yl)carbonylpiperazin-1-ium-1-yl]ethanamide Openeye Name: N,N-diethyl-2-[4-(1-hydroxynaphthalene-2-carbonyl)piperazin-1-ium-1-yl]acetamide CAS Name: N,N-diethyl-2-[4-[(1-hydroxy-2-naphthalenyl)-oxomethyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N,N-diethyl-2-[4-(1-hydroxynaphthalene-2-carbonyl)piperazin-1-ium-1-yl]acetamide Traditional Name: N,N-diethyl-2-[4-(1-hydroxy-2-naphthoyl)piperazin-1-ium-1-yl]acetamide Formula: C21H28N3O3+ MolecularWeight: 370.46532

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C[NH+]1CCN(CC1)C(=O)C2=C(C3=CC=CC=C3C=C2)O

Isomeric SMILES

CCN(CC)C(=O)C[NH+]1CCN(CC1)C(=O)C2=C(C3=CC=CC=C3C=C2)O

InChI

InChI=1S/C21H27N3O3/c1-3-23(4-2)19(25)15-22-11-13-24(14-12-22)21(27)18-10-9-16-7-5-6-8-17(16)20(18)26/h5-10,26H,3-4,11-15H2,1-2H3/p+1