(4-ethylphenyl)methyl-methyl-[(2R)-1-oxidanylidene-1-(3-oxidanylidene-2,4-dihydroquinoxalin-1-yl)propan-2-yl]azanium

Systemtic Name: (4-ethylphenyl)methyl-methyl-[(2R)-1-oxidanylidene-1-(3-oxidanylidene-2,4-dihydroquinoxalin-1-yl)propan-2-yl]azanium Openeye Name: (4-ethylphenyl)methyl-methyl-[(1R)-1-methyl-2-oxo-2-(3-oxo-2,4-dihydroquinoxalin-1-yl)ethyl]ammonium CAS Name: (4-ethylphenyl)methyl-methyl-[(2R)-1-oxo-1-(3-oxo-2,4-dihydroquinoxalin-1-yl)propan-2-yl]ammonium IUPAC Name: (4-ethylphenyl)methyl-methyl-[(2R)-1-oxo-1-(3-oxo-2,4-dihydroquinoxalin-1-yl)propan-2-yl]azanium Traditional Name: (4-ethylbenzyl)-[(1R)-2-keto-2-(3-keto-2,4-dihydroquinoxalin-1-yl)-1-methyl-ethyl]-methyl-ammonium Formula: C21H26N3O2+ MolecularWeight: 352.45004

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C[NH+](C)C(C)C(=O)N2CC(=O)NC3=CC=CC=C32

Isomeric SMILES

CCC1=CC=C(C=C1)C[NH+](C)[C@H](C)C(=O)N2CC(=O)NC3=CC=CC=C32

InChI

InChI=1S/C21H25N3O2/c1-4-16-9-11-17(12-10-16)13-23(3)15(2)21(26)24-14-20(25)22-18-7-5-6-8-19(18)24/h5-12,15H,4,13-14H2,1-3H3,(H,22,25)/p+1/t15-/m1/s1