(5-chloranyl-2,3-dihydro-1,4-benzodioxin-7-yl)methyl (Z)-2-acetamido-3-phenyl-prop-2-enoate

Systemtic Name: (5-chloranyl-2,3-dihydro-1,4-benzodioxin-7-yl)methyl (Z)-2-acetamido-3-phenyl-prop-2-enoate Openeye Name: (5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)methyl (Z)-2-acetamido-3-phenyl-prop-2-enoate CAS Name: (Z)-2-acetamido-3-phenyl-2-propenoic acid (5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)methyl ester IUPAC Name: (5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)methyl (Z)-2-acetamido-3-phenylprop-2-enoate Traditional Name: (Z)-2-acetamido-3-phenyl-acrylic acid (5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)methyl ester Formula: C20H18ClNO5 MolecularWeight: 387.81362

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(=CC1=CC=CC=C1)C(=O)OCC2=CC3=C(C(=C2)Cl)OCCO3

Isomeric SMILES

CC(=O)N/C(=C\C1=CC=CC=C1)/C(=O)OCC2=CC3=C(C(=C2)Cl)OCCO3

InChI

InChI=1S/C20H18ClNO5/c1-13(23)22-17(10-14-5-3-2-4-6-14)20(24)27-12-15-9-16(21)19-18(11-15)25-7-8-26-19/h2-6,9-11H,7-8,12H2,1H3,(H,22,23)/b17-10-