1-[2-[(2-methylpropan-2-yl)oxycarbonylamino]ethyl]-3-oxidanylidene-isoindole-5-carboxylic acid

Systemtic Name: 1-[2-[(2-methylpropan-2-yl)oxycarbonylamino]ethyl]-3-oxidanylidene-isoindole-5-carboxylic acid Openeye Name: 1-[2-(tert-butoxycarbonylamino)ethyl]-3-oxo-isoindole-5-carboxylic acid CAS Name: 1-[2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]ethyl]-3-oxo-5-isoindolecarboxylic acid IUPAC Name: 1-[2-[(2-methylpropan-2-yl)oxycarbonylamino]ethyl]-3-oxoisoindole-5-carboxylic acid Traditional Name: 1-[2-(tert-butoxycarbonylamino)ethyl]-3-keto-isoindole-5-carboxylic acid Formula: C16H18N2O5 MolecularWeight: 318.32452

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCCC1=NC(=O)C2=C1C=CC(=C2)C(=O)O

Isomeric SMILES

CC(C)(C)OC(=O)NCCC1=NC(=O)C2=C1C=CC(=C2)C(=O)O

InChI

InChI=1S/C16H18N2O5/c1-16(2,3)23-15(22)17-7-6-12-10-5-4-9(14(20)21)8-11(10)13(19)18-12/h4-5,8H,6-7H2,1-3H3,(H,17,22)(H,20,21)