methyl 4-[(E)-3-(7-chloranyl-1,3-benzodioxol-5-yl)prop-2-enoyl]oxybenzoate

Systemtic Name: methyl 4-[(E)-3-(7-chloranyl-1,3-benzodioxol-5-yl)prop-2-enoyl]oxybenzoate Openeye Name: methyl 4-[(E)-3-(7-chloro-1,3-benzodioxol-5-yl)prop-2-enoyl]oxybenzoate CAS Name: 4-[(E)-3-(7-chloro-1,3-benzodioxol-5-yl)-1-oxoprop-2-enoxy]benzoic acid methyl ester IUPAC Name: methyl 4-[(E)-3-(7-chloro-1,3-benzodioxol-5-yl)prop-2-enoyl]oxybenzoate Traditional Name: 4-[(E)-3-(7-chloro-1,3-benzodioxol-5-yl)acryloyl]oxybenzoic acid methyl ester Formula: C18H13ClO6 MolecularWeight: 360.74522

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)OC(=O)C=CC2=CC3=C(C(=C2)Cl)OCO3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)OC(=O)/C=C/C2=CC3=C(C(=C2)Cl)OCO3

InChI

InChI=1S/C18H13ClO6/c1-22-18(21)12-3-5-13(6-4-12)25-16(20)7-2-11-8-14(19)17-15(9-11)23-10-24-17/h2-9H,10H2,1H3/b7-2+