N-(furan-2-ylmethyl)-2-[2-[4-(1H-indol-3-yl)piperidin-1-ium-1-yl]ethanoylamino]benzamide

Systemtic Name: N-(furan-2-ylmethyl)-2-[2-[4-(1H-indol-3-yl)piperidin-1-ium-1-yl]ethanoylamino]benzamide Openeye Name: N-(2-furylmethyl)-2-[[2-[4-(1H-indol-3-yl)piperidin-1-ium-1-yl]acetyl]amino]benzamide CAS Name: N-(2-furanylmethyl)-2-[[2-[4-(1H-indol-3-yl)-1-piperidin-1-iumyl]-1-oxoethyl]amino]benzamide IUPAC Name: N-(furan-2-ylmethyl)-2-[[2-[4-(1H-indol-3-yl)piperidin-1-ium-1-yl]acetyl]amino]benzamide Traditional Name: N-(2-furfuryl)-2-[[2-[4-(1H-indol-3-yl)piperidin-1-ium-1-yl]acetyl]amino]benzamide Formula: C27H29N4O3+ MolecularWeight: 457.54416

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1C2=CNC3=CC=CC=C32)CC(=O)NC4=CC=CC=C4C(=O)NCC5=CC=CO5

Isomeric SMILES

C1C[NH+](CCC1C2=CNC3=CC=CC=C32)CC(=O)NC4=CC=CC=C4C(=O)NCC5=CC=CO5

InChI

InChI=1S/C27H28N4O3/c32-26(30-25-10-4-2-8-22(25)27(33)29-16-20-6-5-15-34-20)18-31-13-11-19(12-14-31)23-17-28-24-9-3-1-7-21(23)24/h1-10,15,17,19,28H,11-14,16,18H2,(H,29,33)(H,30,32)/p+1