1-ethyl-2,3-bis(oxidanylidene)-N-[(3S)-1-(phenylmethyl)pyrrolidin-1-ium-3-yl]-4H-quinoxaline-6-carboxamide

Systemtic Name: 1-ethyl-2,3-bis(oxidanylidene)-N-[(3S)-1-(phenylmethyl)pyrrolidin-1-ium-3-yl]-4H-quinoxaline-6-carboxamide Openeye Name: N-[(3S)-1-benzylpyrrolidin-1-ium-3-yl]-1-ethyl-2,3-dioxo-4H-quinoxaline-6-carboxamide CAS Name: 1-ethyl-2,3-dioxo-N-[(3S)-1-(phenylmethyl)-3-pyrrolidin-1-iumyl]-4H-quinoxaline-6-carboxamide IUPAC Name: N-[(3S)-1-benzylpyrrolidin-1-ium-3-yl]-1-ethyl-2,3-dioxo-4H-quinoxaline-6-carboxamide Traditional Name: N-[(3S)-1-benzylpyrrolidin-1-ium-3-yl]-1-ethyl-2,3-diketo-4H-quinoxaline-6-carboxamide Formula: C22H25N4O3+ MolecularWeight: 393.4589

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)C(=O)NC3CC[NH+](C3)CC4=CC=CC=C4)NC(=O)C1=O

Isomeric SMILES

CCN1C2=C(C=C(C=C2)C(=O)N[C@H]3CC[NH+](C3)CC4=CC=CC=C4)NC(=O)C1=O

InChI

InChI=1S/C22H24N4O3/c1-2-26-19-9-8-16(12-18(19)24-21(28)22(26)29)20(27)23-17-10-11-25(14-17)13-15-6-4-3-5-7-15/h3-9,12,17H,2,10-11,13-14H2,1H3,(H,23,27)(H,24,28)/p+1/t17-/m0/s1