ethyl 4-(3-piperazin-4-ium-1-ylpropanoylamino)piperidine-1-carboxylate

Systemtic Name: ethyl 4-(3-piperazin-4-ium-1-ylpropanoylamino)piperidine-1-carboxylate Openeye Name: ethyl 4-(3-piperazin-4-ium-1-ylpropanoylamino)piperidine-1-carboxylate CAS Name: 4-[[1-oxo-3-(1-piperazin-4-iumyl)propyl]amino]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(3-piperazin-4-ium-1-ylpropanoylamino)piperidine-1-carboxylate Traditional Name: 4-(3-piperazin-4-ium-1-ylpropanoylamino)piperidine-1-carboxylic acid ethyl ester Formula: C15H29N4O3+ MolecularWeight: 313.41576

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)NC(=O)CCN2CC[NH2+]CC2

Isomeric SMILES

CCOC(=O)N1CCC(CC1)NC(=O)CCN2CC[NH2+]CC2

InChI

InChI=1S/C15H28N4O3/c1-2-22-15(21)19-9-3-13(4-10-19)17-14(20)5-8-18-11-6-16-7-12-18/h13,16H,2-12H2,1H3,(H,17,20)/p+1