N-[[4-(cyclopropylcarbonylamino)phenyl]methyl]-4-[2-(4-methoxyphenoxy)ethyl]piperazin-4-ium-1-carboxamide

Systemtic Name: N-[[4-(cyclopropylcarbonylamino)phenyl]methyl]-4-[2-(4-methoxyphenoxy)ethyl]piperazin-4-ium-1-carboxamide Openeye Name: N-[[4-(cyclopropanecarbonylamino)phenyl]methyl]-4-[2-(4-methoxyphenoxy)ethyl]piperazin-4-ium-1-carboxamide CAS Name: N-[[4-[[cyclopropyl(oxo)methyl]amino]phenyl]methyl]-4-[2-(4-methoxyphenoxy)ethyl]-1-piperazin-4-iumcarboxamide IUPAC Name: N-[[4-(cyclopropanecarbonylamino)phenyl]methyl]-4-[2-(4-methoxyphenoxy)ethyl]piperazin-4-ium-1-carboxamide Traditional Name: N-[4-(cyclopropanecarbonylamino)benzyl]-4-[2-(4-methoxyphenoxy)ethyl]piperazin-4-ium-1-carboxamide Formula: C25H33N4O4+ MolecularWeight: 453.55392

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)OCC[NH+]2CCN(CC2)C(=O)NCC3=CC=C(C=C3)NC(=O)C4CC4

Isomeric SMILES

COC1=CC=C(C=C1)OCC[NH+]2CCN(CC2)C(=O)NCC3=CC=C(C=C3)NC(=O)C4CC4

InChI

InChI=1S/C25H32N4O4/c1-32-22-8-10-23(11-9-22)33-17-16-28-12-14-29(15-13-28)25(31)26-18-19-2-6-21(7-3-19)27-24(30)20-4-5-20/h2-3,6-11,20H,4-5,12-18H2,1H3,(H,26,31)(H,27,30)/p+1