(2R,3R,4R)-3-chloranyl-3-nitro-2-phenyl-8-prop-2-enyl-2,4-dihydrochromen-4-ol

Systemtic Name: (2R,3R,4R)-3-chloranyl-3-nitro-2-phenyl-8-prop-2-enyl-2,4-dihydrochromen-4-ol Openeye Name: (2R,3R,4R)-8-allyl-3-chloro-3-nitro-2-phenyl-chroman-4-ol CAS Name: (2R,3R,4R)-3-chloro-3-nitro-2-phenyl-8-prop-2-enyl-3,4-dihydro-2H-1-benzopyran-4-ol IUPAC Name: (2R,3R,4R)-3-chloro-3-nitro-2-phenyl-8-prop-2-enyl-2,4-dihydrochromen-4-ol Traditional Name: (2R,3R,4R)-8-allyl-3-chloro-3-nitro-2-phenyl-chroman-4-ol Formula: C18H16ClNO4 MolecularWeight: 345.77694

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Descriptors Computed from Structure

Canonical SMILES:

C=CCC1=CC=CC2=C1OC(C(C2O)([N+](=O)[O-])Cl)C3=CC=CC=C3

Isomeric SMILES

C=CCC1=CC=CC2=C1O[C@@H]([C@]([C@@H]2O)([N+](=O)[O-])Cl)C3=CC=CC=C3

InChI

InChI=1S/C18H16ClNO4/c1-2-7-12-10-6-11-14-15(12)24-17(13-8-4-3-5-9-13)18(19,16(14)21)20(22)23/h2-6,8-11,16-17,21H,1,7H2/t16-,17-,18+/m1/s1