[2-benzamido-2-[4-[(Z)-N'-ethoxycarbonylcarbamimidoyl]piperidin-4-yl]oxy-ethanoyl] propanoate

Systemtic Name: [2-benzamido-2-[4-[(Z)-N'-ethoxycarbonylcarbamimidoyl]piperidin-4-yl]oxy-ethanoyl] propanoate Openeye Name: [2-benzamido-2-[[4-[(Z)-N'-ethoxycarbonylcarbamimidoyl]-4-piperidyl]oxy]acetyl] propanoate CAS Name: propanoic acid [2-[[4-[(Z)-amino(ethoxycarbonylimino)methyl]-4-piperidinyl]oxy]-2-benzamido-1-oxoethyl] ester IUPAC Name: [2-benzamido-2-[4-[(Z)-N'-ethoxycarbonylcarbamimidoyl]piperidin-4-yl]oxyacetyl] propanoate Traditional Name: propionic acid [2-benzamido-2-[[4-[(Z)-N'-carbethoxyamidino]-4-piperidyl]oxy]acetyl] ester Formula: C21H28N4O7 MolecularWeight: 448.46962

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)OC(=O)C(NC(=O)C1=CC=CC=C1)OC2(CCNCC2)C(=NC(=O)OCC)N

Isomeric SMILES

CCC(=O)OC(=O)C(NC(=O)C1=CC=CC=C1)OC2(CCNCC2)/C(=N/C(=O)OCC)/N

InChI

InChI=1S/C21H28N4O7/c1-3-15(26)31-18(28)17(24-16(27)14-8-6-5-7-9-14)32-21(10-12-23-13-11-21)19(22)25-20(29)30-4-2/h5-9,17,23H,3-4,10-13H2,1-2H3,(H,24,27)(H2,22,25,29)