1,3-benzodioxol-5-yl (E)-3-(4-nitrophenyl)prop-2-enoate

Systemtic Name: 1,3-benzodioxol-5-yl (E)-3-(4-nitrophenyl)prop-2-enoate Openeye Name: 1,3-benzodioxol-5-yl (E)-3-(4-nitrophenyl)prop-2-enoate CAS Name: (E)-3-(4-nitrophenyl)-2-propenoic acid 1,3-benzodioxol-5-yl ester IUPAC Name: 1,3-benzodioxol-5-yl (E)-3-(4-nitrophenyl)prop-2-enoate Traditional Name: (E)-3-(4-nitrophenyl)acrylic acid 1,3-benzodioxol-5-yl ester Formula: C16H11NO6 MolecularWeight: 313.26164

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)OC(=O)C=CC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)OC(=O)/C=C/C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H11NO6/c18-16(8-3-11-1-4-12(5-2-11)17(19)20)23-13-6-7-14-15(9-13)22-10-21-14/h1-9H,10H2/b8-3+