N-[4-(azepan-1-yl)phenyl]-2-(4-ethylpiperazine-1,4-diium-1-yl)ethanamide

Systemtic Name: N-[4-(azepan-1-yl)phenyl]-2-(4-ethylpiperazine-1,4-diium-1-yl)ethanamide Openeye Name: N-[4-(azepan-1-yl)phenyl]-2-(4-ethylpiperazine-1,4-diium-1-yl)acetamide CAS Name: N-[4-(1-azepanyl)phenyl]-2-(4-ethyl-1-piperazine-1,4-diiumyl)acetamide IUPAC Name: N-[4-(azepan-1-yl)phenyl]-2-(4-ethylpiperazine-1,4-diium-1-yl)acetamide Traditional Name: N-[4-(azepan-1-yl)phenyl]-2-(4-ethylpiperazine-1,4-diium-1-yl)acetamide Formula: C20H34N4O+2 MolecularWeight: 346.51016

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CC[NH+](CC1)CC(=O)NC2=CC=C(C=C2)N3CCCCCC3

Isomeric SMILES

CC[NH+]1CC[NH+](CC1)CC(=O)NC2=CC=C(C=C2)N3CCCCCC3

InChI

InChI=1S/C20H32N4O/c1-2-22-13-15-23(16-14-22)17-20(25)21-18-7-9-19(10-8-18)24-11-5-3-4-6-12-24/h7-10H,2-6,11-17H2,1H3,(H,21,25)/p+2