(4-nitrophenyl)methyl N-[(2S)-butan-2-yl]carbamate

Systemtic Name: (4-nitrophenyl)methyl N-[(2S)-butan-2-yl]carbamate Openeye Name: (4-nitrophenyl)methyl N-[(1S)-1-methylpropyl]carbamate CAS Name: N-[(2S)-butan-2-yl]carbamic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl N-[(2S)-butan-2-yl]carbamate Traditional Name: N-[(1S)-1-methylpropyl]carbamic acid (4-nitrobenzyl) ester Formula: C12H16N2O4 MolecularWeight: 252.26644

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)OCC1=CC=C(C=C1)[N+](=O)[O-]

Isomeric SMILES

CC[C@H](C)NC(=O)OCC1=CC=C(C=C1)[N+](=O)[O-]

InChI

InChI=1S/C12H16N2O4/c1-3-9(2)13-12(15)18-8-10-4-6-11(7-5-10)14(16)17/h4-7,9H,3,8H2,1-2H3,(H,13,15)/t9-/m0/s1