tert-butyl N-[(2R)-1-[(2-azanyl-5-nitro-4-oxidanylidene-1H-pyrimidin-6-yl)amino]-3-oxidanyl-propan-2-yl]-N-(phenylmethyl)carbamate

Systemtic Name: tert-butyl N-[(2R)-1-[(2-azanyl-5-nitro-4-oxidanylidene-1H-pyrimidin-6-yl)amino]-3-oxidanyl-propan-2-yl]-N-(phenylmethyl)carbamate Openeye Name: tert-butyl N-[(1R)-1-[[(2-amino-5-nitro-4-oxo-1H-pyrimidin-6-yl)amino]methyl]-2-hydroxy-ethyl]-N-benzyl-carbamate CAS Name: N-[(2R)-1-[(2-amino-5-nitro-4-oxo-1H-pyrimidin-6-yl)amino]-3-hydroxypropan-2-yl]-N-(phenylmethyl)carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(2R)-1-[(2-amino-5-nitro-4-oxo-1H-pyrimidin-6-yl)amino]-3-hydroxypropan-2-yl]-N-benzylcarbamate Traditional Name: N-[(1R)-1-[[(2-amino-4-keto-5-nitro-1H-pyrimidin-6-yl)amino]methyl]-2-hydroxy-ethyl]-N-benzyl-carbamic acid tert-butyl ester Formula: C19H26N6O6 MolecularWeight: 434.44634

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N(CC1=CC=CC=C1)C(CNC2=C(C(=O)N=C(N2)N)[N+](=O)[O-])CO

Isomeric SMILES

CC(C)(C)OC(=O)N(CC1=CC=CC=C1)[C@H](CNC2=C(C(=O)N=C(N2)N)[N+](=O)[O-])CO

InChI

InChI=1S/C19H26N6O6/c1-19(2,3)31-18(28)24(10-12-7-5-4-6-8-12)13(11-26)9-21-15-14(25(29)30)16(27)23-17(20)22-15/h4-8,13,26H,9-11H2,1-3H3,(H4,20,21,22,23,27)/t13-/m1/s1