2,3-diethyl-N-[1-(2-oxidanylidene-2-phenylazanyl-ethyl)piperidin-1-ium-4-yl]quinoxaline-6-carboxamide

Systemtic Name: 2,3-diethyl-N-[1-(2-oxidanylidene-2-phenylazanyl-ethyl)piperidin-1-ium-4-yl]quinoxaline-6-carboxamide Openeye Name: N-[1-(2-anilino-2-oxo-ethyl)piperidin-1-ium-4-yl]-2,3-diethyl-quinoxaline-6-carboxamide CAS Name: N-[1-(2-anilino-2-oxoethyl)-4-piperidin-1-iumyl]-2,3-diethyl-6-quinoxalinecarboxamide IUPAC Name: N-[1-(2-anilino-2-oxoethyl)piperidin-1-ium-4-yl]-2,3-diethylquinoxaline-6-carboxamide Traditional Name: N-[1-(2-anilino-2-keto-ethyl)piperidin-1-ium-4-yl]-2,3-diethyl-quinoxaline-6-carboxamide Formula: C26H32N5O2+ MolecularWeight: 446.56458

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=C(C=C(C=C2)C(=O)NC3CC[NH+](CC3)CC(=O)NC4=CC=CC=C4)N=C1CC

Isomeric SMILES

CCC1=NC2=C(C=C(C=C2)C(=O)NC3CC[NH+](CC3)CC(=O)NC4=CC=CC=C4)N=C1CC

InChI

InChI=1S/C26H31N5O2/c1-3-21-22(4-2)30-24-16-18(10-11-23(24)29-21)26(33)28-20-12-14-31(15-13-20)17-25(32)27-19-8-6-5-7-9-19/h5-11,16,20H,3-4,12-15,17H2,1-2H3,(H,27,32)(H,28,33)/p+1