[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl (E)-3-(4-nitrophenyl)prop-2-enoate

Systemtic Name: [(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl (E)-3-(4-nitrophenyl)prop-2-enoate Openeye Name: [(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl (E)-3-(4-nitrophenyl)prop-2-enoate CAS Name: (E)-3-(4-nitrophenyl)-2-propenoic acid [(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl ester IUPAC Name: [(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl (E)-3-(4-nitrophenyl)prop-2-enoate Traditional Name: (E)-3-(4-nitrophenyl)acrylic acid [(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl ester Formula: C18H15NO6 MolecularWeight: 341.3148

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC2=CC=CC=C2O1)COC(=O)C=CC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1[C@H](OC2=CC=CC=C2O1)COC(=O)/C=C/C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H15NO6/c20-18(10-7-13-5-8-14(9-6-13)19(21)22)24-12-15-11-23-16-3-1-2-4-17(16)25-15/h1-10,15H,11-12H2/b10-7+/t15-/m0/s1