N-[2-(4-methylpiperazin-4-ium-1-yl)ethyl]-4-(1-phenethylpiperidin-1-ium-4-yl)oxy-benzamide

Systemtic Name: N-[2-(4-methylpiperazin-4-ium-1-yl)ethyl]-4-(1-phenethylpiperidin-1-ium-4-yl)oxy-benzamide Openeye Name: N-[2-(4-methylpiperazin-4-ium-1-yl)ethyl]-4-(1-phenethylpiperidin-1-ium-4-yl)oxy-benzamide CAS Name: N-[2-(4-methyl-1-piperazin-4-iumyl)ethyl]-4-[(1-phenethyl-4-piperidin-1-iumyl)oxy]benzamide IUPAC Name: N-[2-(4-methylpiperazin-4-ium-1-yl)ethyl]-4-(1-phenethylpiperidin-1-ium-4-yl)oxybenzamide Traditional Name: N-[2-(4-methylpiperazin-4-ium-1-yl)ethyl]-4-(1-phenethylpiperidin-1-ium-4-yl)oxy-benzamide Formula: C27H40N4O2+2 MolecularWeight: 452.6321

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)CCNC(=O)C2=CC=C(C=C2)OC3CC[NH+](CC3)CCC4=CC=CC=C4

Isomeric SMILES

C[NH+]1CCN(CC1)CCNC(=O)C2=CC=C(C=C2)OC3CC[NH+](CC3)CCC4=CC=CC=C4

InChI

InChI=1S/C27H38N4O2/c1-29-19-21-31(22-20-29)18-14-28-27(32)24-7-9-25(10-8-24)33-26-12-16-30(17-13-26)15-11-23-5-3-2-4-6-23/h2-10,26H,11-22H2,1H3,(H,28,32)/p+2