N-(2-chlorophenyl)-2-[4-(3-ethoxynaphthalen-2-yl)carbonylpiperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-(2-chlorophenyl)-2-[4-(3-ethoxynaphthalen-2-yl)carbonylpiperazin-1-ium-1-yl]ethanamide Openeye Name: N-(2-chlorophenyl)-2-[4-(3-ethoxynaphthalene-2-carbonyl)piperazin-1-ium-1-yl]acetamide CAS Name: N-(2-chlorophenyl)-2-[4-[(3-ethoxy-2-naphthalenyl)-oxomethyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N-(2-chlorophenyl)-2-[4-(3-ethoxynaphthalene-2-carbonyl)piperazin-1-ium-1-yl]acetamide Traditional Name: N-(2-chlorophenyl)-2-[4-(3-ethoxy-2-naphthoyl)piperazin-1-ium-1-yl]acetamide Formula: C25H27ClN3O3+ MolecularWeight: 452.95318

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=CC=CC=C2C=C1C(=O)N3CC[NH+](CC3)CC(=O)NC4=CC=CC=C4Cl

Isomeric SMILES

CCOC1=CC2=CC=CC=C2C=C1C(=O)N3CC[NH+](CC3)CC(=O)NC4=CC=CC=C4Cl

InChI

InChI=1S/C25H26ClN3O3/c1-2-32-23-16-19-8-4-3-7-18(19)15-20(23)25(31)29-13-11-28(12-14-29)17-24(30)27-22-10-6-5-9-21(22)26/h3-10,15-16H,2,11-14,17H2,1H3,(H,27,30)/p+1