[(2R,5S)-3-methylidene-5-(4-nitrophenyl)-5-oxidanyl-pentan-2-yl] N,N-dimethylcarbamate

Systemtic Name: [(2R,5S)-3-methylidene-5-(4-nitrophenyl)-5-oxidanyl-pentan-2-yl] N,N-dimethylcarbamate Openeye Name: [(1R,4S)-4-hydroxy-1-methyl-2-methylene-4-(4-nitrophenyl)butyl] N,N-dimethylcarbamate CAS Name: N,N-dimethylcarbamic acid [(2R,5S)-5-hydroxy-3-methylene-5-(4-nitrophenyl)pentan-2-yl] ester IUPAC Name: [(2R,5S)-5-hydroxy-3-methylidene-5-(4-nitrophenyl)pentan-2-yl] N,N-dimethylcarbamate Traditional Name: N,N-dimethylcarbamic acid [(1R)-2-[(2S)-2-hydroxy-2-(4-nitrophenyl)ethyl]-1-methyl-allyl] ester Formula: C15H20N2O5 MolecularWeight: 308.3297

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=C)CC(C1=CC=C(C=C1)[N+](=O)[O-])O)OC(=O)N(C)C

Isomeric SMILES

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

InChI

InChI=1S/C15H20N2O5/c1-10(11(2)22-15(19)16(3)4)9-14(18)12-5-7-13(8-6-12)17(20)21/h5-8,11,14,18H,1,9H2,2-4H3/t11-,14+/m1/s1