2-[2-[4-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl]ethyl]-3-oxidanylidene-butanoate

Systemtic Name: 2-[2-[4-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl]ethyl]-3-oxidanylidene-butanoate Openeye Name: 2-[2-[4-(tert-butoxycarbonylamino)phenyl]ethyl]-3-oxo-butanoate CAS Name: 2-[2-[4-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]phenyl]ethyl]-3-oxobutanoate IUPAC Name: 2-[2-[4-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl]ethyl]-3-oxobutanoate Traditional Name: 2-[2-[4-(tert-butoxycarbonylamino)phenyl]ethyl]-3-keto-butyrate Formula: C17H22NO5- MolecularWeight: 320.36028

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(CCC1=CC=C(C=C1)NC(=O)OC(C)(C)C)C(=O)[O-]

Isomeric SMILES

CC(=O)C(CCC1=CC=C(C=C1)NC(=O)OC(C)(C)C)C(=O)[O-]

InChI

InChI=1S/C17H23NO5/c1-11(19)14(15(20)21)10-7-12-5-8-13(9-6-12)18-16(22)23-17(2,3)4/h5-6,8-9,14H,7,10H2,1-4H3,(H,18,22)(H,20,21)/p-1