2-[(2R)-1-(furan-3-ylmethyl)-3-oxidanylidene-piperazin-1-ium-2-yl]-N-(2-indol-1-ylethyl)ethanamide

Systemtic Name: 2-[(2R)-1-(furan-3-ylmethyl)-3-oxidanylidene-piperazin-1-ium-2-yl]-N-(2-indol-1-ylethyl)ethanamide Openeye Name: 2-[(2R)-1-(3-furylmethyl)-3-oxo-piperazin-1-ium-2-yl]-N-(2-indol-1-ylethyl)acetamide CAS Name: 2-[(2R)-1-(3-furanylmethyl)-3-oxo-2-piperazin-1-iumyl]-N-[2-(1-indolyl)ethyl]acetamide IUPAC Name: 2-[(2R)-1-(furan-3-ylmethyl)-3-oxopiperazin-1-ium-2-yl]-N-(2-indol-1-ylethyl)acetamide Traditional Name: 2-[(2R)-1-(3-furfuryl)-3-keto-piperazin-1-ium-2-yl]-N-(2-indol-1-ylethyl)acetamide Formula: C21H25N4O3+ MolecularWeight: 381.4482

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](C(C(=O)N1)CC(=O)NCCN2C=CC3=CC=CC=C32)CC4=COC=C4

Isomeric SMILES

C1C[NH+]([C@@H](C(=O)N1)CC(=O)NCCN2C=CC3=CC=CC=C32)CC4=COC=C4

InChI

InChI=1S/C21H24N4O3/c26-20(22-7-10-24-9-5-17-3-1-2-4-18(17)24)13-19-21(27)23-8-11-25(19)14-16-6-12-28-15-16/h1-6,9,12,15,19H,7-8,10-11,13-14H2,(H,22,26)(H,23,27)/p+1/t19-/m1/s1