N-[(2S)-2-(furan-2-yl)-2-piperidin-1-ium-1-yl-ethyl]-2,3-bis(oxidanylidene)-1,4-dihydroquinoxaline-6-carboxamide

Systemtic Name: N-[(2S)-2-(furan-2-yl)-2-piperidin-1-ium-1-yl-ethyl]-2,3-bis(oxidanylidene)-1,4-dihydroquinoxaline-6-carboxamide Openeye Name: N-[(2S)-2-(2-furyl)-2-piperidin-1-ium-1-yl-ethyl]-2,3-dioxo-1,4-dihydroquinoxaline-6-carboxamide CAS Name: N-[(2S)-2-(2-furanyl)-2-(1-piperidin-1-iumyl)ethyl]-2,3-dioxo-1,4-dihydroquinoxaline-6-carboxamide IUPAC Name: N-[(2S)-2-(furan-2-yl)-2-piperidin-1-ium-1-ylethyl]-2,3-dioxo-1,4-dihydroquinoxaline-6-carboxamide Traditional Name: N-[(2S)-2-(2-furyl)-2-piperidin-1-ium-1-yl-ethyl]-2,3-diketo-1,4-dihydroquinoxaline-6-carboxamide Formula: C20H23N4O4+ MolecularWeight: 383.42102

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)C(CNC(=O)C2=CC3=C(C=C2)NC(=O)C(=O)N3)C4=CC=CO4

Isomeric SMILES

C1CC[NH+](CC1)[C@@H](CNC(=O)C2=CC3=C(C=C2)NC(=O)C(=O)N3)C4=CC=CO4

InChI

InChI=1S/C20H22N4O4/c25-18(13-6-7-14-15(11-13)23-20(27)19(26)22-14)21-12-16(17-5-4-10-28-17)24-8-2-1-3-9-24/h4-7,10-11,16H,1-3,8-9,12H2,(H,21,25)(H,22,26)(H,23,27)/p+1/t16-/m0/s1