(E)-3-[(3S)-6-nitro-3,4-dihydro-2H-chromen-3-yl]prop-2-enoic acid

Systemtic Name: (E)-3-[(3S)-6-nitro-3,4-dihydro-2H-chromen-3-yl]prop-2-enoic acid Openeye Name: (E)-3-[(3S)-6-nitrochroman-3-yl]prop-2-enoic acid CAS Name: (E)-3-[(3S)-6-nitro-3,4-dihydro-2H-1-benzopyran-3-yl]-2-propenoic acid IUPAC Name: (E)-3-[(3S)-6-nitro-3,4-dihydro-2H-chromen-3-yl]prop-2-enoic acid Traditional Name: (E)-3-[(3S)-6-nitrochroman-3-yl]acrylic acid Formula: C12H11NO5 MolecularWeight: 249.21944

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Descriptors Computed from Structure

Canonical SMILES:

C1C(COC2=C1C=C(C=C2)[N+](=O)[O-])C=CC(=O)O

Isomeric SMILES

C1[C@H](COC2=C1C=C(C=C2)[N+](=O)[O-])/C=C/C(=O)O

InChI

InChI=1S/C12H11NO5/c14-12(15)4-1-8-5-9-6-10(13(16)17)2-3-11(9)18-7-8/h1-4,6,8H,5,7H2,(H,14,15)/b4-1+/t8-/m1/s1