aniline; 3-[(2-methylpropan-2-yl)oxy]-3-oxidanylidene-propanoic acid

Systemtic Name: aniline; 3-[(2-methylpropan-2-yl)oxy]-3-oxidanylidene-propanoic acid Openeye Name: aniline; 3-tert-butoxy-3-oxo-propanoic acid CAS Name: aniline; 3-[(2-methylpropan-2-yl)oxy]-3-oxopropanoic acid IUPAC Name: aniline; 3-[(2-methylpropan-2-yl)oxy]-3-oxopropanoic acid Traditional Name: 3-tert-butoxy-3-keto-propionic acid; phenylamine Formula: C13H19NO4 MolecularWeight: 253.29426

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CC(=O)O.C1=CC=C(C=C1)N

Isomeric SMILES

CC(C)(C)OC(=O)CC(=O)O.C1=CC=C(C=C1)N

InChI

InChI=1S/C7H12O4.C6H7N/c1-7(2,3)11-6(10)4-5(8)9;7-6-4-2-1-3-5-6/h4H2,1-3H3,(H,8,9);1-5H,7H2