(2R)-4-methyl-2-[(1R)-2-nitro-1-thiophen-2-yl-ethyl]pent-3-enal

Systemtic Name: (2R)-4-methyl-2-[(1R)-2-nitro-1-thiophen-2-yl-ethyl]pent-3-enal Openeye Name: (2R)-4-methyl-2-[(1R)-2-nitro-1-(2-thienyl)ethyl]pent-3-enal CAS Name: (2R)-4-methyl-2-[(1R)-2-nitro-1-thiophen-2-ylethyl]-3-pentenal IUPAC Name: (2R)-4-methyl-2-[(1R)-2-nitro-1-thiophen-2-ylethyl]pent-3-enal Traditional Name: (2R)-4-methyl-2-[(1R)-2-nitro-1-(2-thienyl)ethyl]pent-3-enal Formula: C12H15NO3S MolecularWeight: 253.3174

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(C=O)C(C[N+](=O)[O-])C1=CC=CS1)C

Isomeric SMILES

CC(=C[C@@H](C=O)[C@H](C[N+](=O)[O-])C1=CC=CS1)C

InChI

InChI=1S/C12H15NO3S/c1-9(2)6-10(8-14)11(7-13(15)16)12-4-3-5-17-12/h3-6,8,10-11H,7H2,1-2H3/t10-,11-/m0/s1