(2S,3R)-2,3-dimethyl-1-[(2-methylpropan-2-yl)oxycarbonyl]-3,4-dihydro-2H-quinoxaline-6-carboxylic acid

Systemtic Name: (2S,3R)-2,3-dimethyl-1-[(2-methylpropan-2-yl)oxycarbonyl]-3,4-dihydro-2H-quinoxaline-6-carboxylic acid Openeye Name: (2S,3R)-1-tert-butoxycarbonyl-2,3-dimethyl-3,4-dihydro-2H-quinoxaline-6-carboxylic acid CAS Name: (2S,3R)-2,3-dimethyl-1-[(2-methylpropan-2-yl)oxy-oxomethyl]-3,4-dihydro-2H-quinoxaline-6-carboxylic acid IUPAC Name: (2S,3R)-2,3-dimethyl-1-[(2-methylpropan-2-yl)oxycarbonyl]-3,4-dihydro-2H-quinoxaline-6-carboxylic acid Traditional Name: (2S,3R)-1-tert-butoxycarbonyl-2,3-dimethyl-3,4-dihydro-2H-quinoxaline-6-carboxylic acid Formula: C16H22N2O4 MolecularWeight: 306.35688

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(N(C2=C(N1)C=C(C=C2)C(=O)O)C(=O)OC(C)(C)C)C

Isomeric SMILES

C[C@@H]1[C@@H](N(C2=C(N1)C=C(C=C2)C(=O)O)C(=O)OC(C)(C)C)C

InChI

InChI=1S/C16H22N2O4/c1-9-10(2)18(15(21)22-16(3,4)5)13-7-6-11(14(19)20)8-12(13)17-9/h6-10,17H,1-5H3,(H,19,20)/t9-,10+/m1/s1