(3S)-3-(furan-2-yl)-4-methyl-4-nitro-1-phenyl-pentan-1-one

Systemtic Name: (3S)-3-(furan-2-yl)-4-methyl-4-nitro-1-phenyl-pentan-1-one Openeye Name: (3S)-3-(2-furyl)-4-methyl-4-nitro-1-phenyl-pentan-1-one CAS Name: (3S)-3-(2-furanyl)-4-methyl-4-nitro-1-phenyl-1-pentanone IUPAC Name: (3S)-3-(furan-2-yl)-4-methyl-4-nitro-1-phenylpentan-1-one Traditional Name: (3S)-3-(2-furyl)-4-methyl-4-nitro-1-phenyl-pentan-1-one Formula: C16H17NO4 MolecularWeight: 287.31048

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(CC(=O)C1=CC=CC=C1)C2=CC=CO2)[N+](=O)[O-]

Isomeric SMILES

CC(C)([C@H](CC(=O)C1=CC=CC=C1)C2=CC=CO2)[N+](=O)[O-]

InChI

InChI=1S/C16H17NO4/c1-16(2,17(19)20)13(15-9-6-10-21-15)11-14(18)12-7-4-3-5-8-12/h3-10,13H,11H2,1-2H3/t13-/m1/s1