(1S,2R)-2-nitro-1-phenyl-N-prop-2-enyl-butan-1-amine

Systemtic Name: (1S,2R)-2-nitro-1-phenyl-N-prop-2-enyl-butan-1-amine Openeye Name: (1S,2R)-N-allyl-2-nitro-1-phenyl-butan-1-amine CAS Name: (1S,2R)-2-nitro-1-phenyl-N-prop-2-enyl-1-butanamine IUPAC Name: (1S,2R)-2-nitro-1-phenyl-N-prop-2-enylbutan-1-amine Traditional Name: allyl-[(1S,2R)-2-nitro-1-phenyl-butyl]amine Formula: C13H18N2O2 MolecularWeight: 234.29422

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H18N2O2/c1-3-10-14-13(12(4-2)15(16)17)11-8-6-5-7-9-11/h3,5-9,12-14H,1,4,10H2,2H3/t12-,13+/m1/s1