3-[(2-methylpropan-2-yl)oxycarbonylamino]-4-oxidanylidene-4-[(phenylmethyl)amino]butanoate

Systemtic Name: 3-[(2-methylpropan-2-yl)oxycarbonylamino]-4-oxidanylidene-4-[(phenylmethyl)amino]butanoate Openeye Name: 4-(benzylamino)-3-(tert-butoxycarbonylamino)-4-oxo-butanoate CAS Name: 3-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-4-oxo-4-[(phenylmethyl)amino]butanoate IUPAC Name: 4-(benzylamino)-3-[(2-methylpropan-2-yl)oxycarbonylamino]-4-oxobutanoate Traditional Name: 4-(benzylamino)-3-(tert-butoxycarbonylamino)-4-keto-butyrate Formula: C16H21N2O5- MolecularWeight: 321.34834

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC(=O)[O-])C(=O)NCC1=CC=CC=C1

Isomeric SMILES

CC(C)(C)OC(=O)NC(CC(=O)[O-])C(=O)NCC1=CC=CC=C1

InChI

InChI=1S/C16H22N2O5/c1-16(2,3)23-15(22)18-12(9-13(19)20)14(21)17-10-11-7-5-4-6-8-11/h4-8,12H,9-10H2,1-3H3,(H,17,21)(H,18,22)(H,19,20)/p-1