1-(2-chlorophenyl)ethyl (E)-3-(6-nitro-1,3-benzodioxol-5-yl)prop-2-enoate

Systemtic Name: 1-(2-chlorophenyl)ethyl (E)-3-(6-nitro-1,3-benzodioxol-5-yl)prop-2-enoate Openeye Name: 1-(2-chlorophenyl)ethyl (E)-3-(6-nitro-1,3-benzodioxol-5-yl)prop-2-enoate CAS Name: (E)-3-(6-nitro-1,3-benzodioxol-5-yl)-2-propenoic acid 1-(2-chlorophenyl)ethyl ester IUPAC Name: 1-(2-chlorophenyl)ethyl (E)-3-(6-nitro-1,3-benzodioxol-5-yl)prop-2-enoate Traditional Name: (E)-3-(6-nitro-1,3-benzodioxol-5-yl)acrylic acid 1-(2-chlorophenyl)ethyl ester Formula: C18H14ClNO6 MolecularWeight: 375.75986

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1Cl)OC(=O)C=CC2=CC3=C(C=C2[N+](=O)[O-])OCO3

Isomeric SMILES

CC(C1=CC=CC=C1Cl)OC(=O)/C=C/C2=CC3=C(C=C2[N+](=O)[O-])OCO3

InChI

InChI=1S/C18H14ClNO6/c1-11(13-4-2-3-5-14(13)19)26-18(21)7-6-12-8-16-17(25-10-24-16)9-15(12)20(22)23/h2-9,11H,10H2,1H3/b7-6+