N-[(5-chloranyl-1H-indol-2-yl)methyl]-2-[(2R)-1-(furan-3-ylmethyl)-3-oxidanylidene-piperazin-1-ium-2-yl]ethanamide

Systemtic Name: N-[(5-chloranyl-1H-indol-2-yl)methyl]-2-[(2R)-1-(furan-3-ylmethyl)-3-oxidanylidene-piperazin-1-ium-2-yl]ethanamide Openeye Name: N-[(5-chloro-1H-indol-2-yl)methyl]-2-[(2R)-1-(3-furylmethyl)-3-oxo-piperazin-1-ium-2-yl]acetamide CAS Name: N-[(5-chloro-1H-indol-2-yl)methyl]-2-[(2R)-1-(3-furanylmethyl)-3-oxo-2-piperazin-1-iumyl]acetamide IUPAC Name: N-[(5-chloro-1H-indol-2-yl)methyl]-2-[(2R)-1-(furan-3-ylmethyl)-3-oxopiperazin-1-ium-2-yl]acetamide Traditional Name: N-[(5-chloro-1H-indol-2-yl)methyl]-2-[(2R)-1-(3-furfuryl)-3-keto-piperazin-1-ium-2-yl]acetamide Formula: C20H22ClN4O3+ MolecularWeight: 401.86668

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](C(C(=O)N1)CC(=O)NCC2=CC3=C(N2)C=CC(=C3)Cl)CC4=COC=C4

Isomeric SMILES

C1C[NH+]([C@@H](C(=O)N1)CC(=O)NCC2=CC3=C(N2)C=CC(=C3)Cl)CC4=COC=C4

InChI

InChI=1S/C20H21ClN4O3/c21-15-1-2-17-14(7-15)8-16(24-17)10-23-19(26)9-18-20(27)22-4-5-25(18)11-13-3-6-28-12-13/h1-3,6-8,12,18,24H,4-5,9-11H2,(H,22,27)(H,23,26)/p+1/t18-/m1/s1