N-(pentan-3-ylideneamino)-3-(4-phenylpiperazin-1-ium-1-yl)propanamide

Systemtic Name: N-(pentan-3-ylideneamino)-3-(4-phenylpiperazin-1-ium-1-yl)propanamide Openeye Name: N-(1-ethylpropylideneamino)-3-(4-phenylpiperazin-1-ium-1-yl)propanamide CAS Name: N-(pentan-3-ylideneamino)-3-(4-phenyl-1-piperazin-1-iumyl)propanamide IUPAC Name: N-(pentan-3-ylideneamino)-3-(4-phenylpiperazin-1-ium-1-yl)propanamide Traditional Name: N-(1-ethylpropylideneamino)-3-(4-phenylpiperazin-1-ium-1-yl)propionamide Formula: C18H29N4O+ MolecularWeight: 317.44906

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=NNC(=O)CC[NH+]1CCN(CC1)C2=CC=CC=C2)CC

Isomeric SMILES

CCC(=NNC(=O)CC[NH+]1CCN(CC1)C2=CC=CC=C2)CC

InChI

InChI=1S/C18H28N4O/c1-3-16(4-2)19-20-18(23)10-11-21-12-14-22(15-13-21)17-8-6-5-7-9-17/h5-9H,3-4,10-15H2,1-2H3,(H,20,23)/p+1