2-piperidin-4-yloxyethanoyl 3-(4-hydroxyphenyl)-2-[[4-(N'-propylcarbamimidoyl)phenyl]carbonylamino]propanoate

Systemtic Name: 2-piperidin-4-yloxyethanoyl 3-(4-hydroxyphenyl)-2-[[4-(N'-propylcarbamimidoyl)phenyl]carbonylamino]propanoate Openeye Name: [2-(4-piperidyloxy)acetyl] 3-(4-hydroxyphenyl)-2-[[4-(N'-propylcarbamimidoyl)benzoyl]amino]propanoate CAS Name: 2-[[[4-[amino(propylimino)methyl]phenyl]-oxomethyl]amino]-3-(4-hydroxyphenyl)propanoic acid [1-oxo-2-(4-piperidinyloxy)ethyl] ester IUPAC Name: (2-piperidin-4-yloxyacetyl) 3-(4-hydroxyphenyl)-2-[[4-(N'-propylcarbamimidoyl)benzoyl]amino]propanoate Traditional Name: 3-(4-hydroxyphenyl)-2-[[4-(N'-propylamidino)benzoyl]amino]propionic acid [2-(4-piperidyloxy)acetyl] ester Formula: C27H34N4O6 MolecularWeight: 510.58206

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Descriptors Computed from Structure

Canonical SMILES:

CCCN=C(C1=CC=C(C=C1)C(=O)NC(CC2=CC=C(C=C2)O)C(=O)OC(=O)COC3CCNCC3)N

Isomeric SMILES

CCCN=C(C1=CC=C(C=C1)C(=O)NC(CC2=CC=C(C=C2)O)C(=O)OC(=O)COC3CCNCC3)N

InChI

InChI=1S/C27H34N4O6/c1-2-13-30-25(28)19-5-7-20(8-6-19)26(34)31-23(16-18-3-9-21(32)10-4-18)27(35)37-24(33)17-36-22-11-14-29-15-12-22/h3-10,22-23,29,32H,2,11-17H2,1H3,(H2,28,30)(H,31,34)