ethyl N-[5-chloranyl-2-[(E)-3-ethoxy-3-oxidanyl-2-(phenylcarbonyl)prop-2-enoyl]phenyl]carbamate

Systemtic Name: ethyl N-[5-chloranyl-2-[(E)-3-ethoxy-3-oxidanyl-2-(phenylcarbonyl)prop-2-enoyl]phenyl]carbamate Openeye Name: ethyl N-[2-[(E)-2-benzoyl-3-ethoxy-3-hydroxy-prop-2-enoyl]-5-chloro-phenyl]carbamate CAS Name: N-[2-[(E)-2-benzoyl-3-ethoxy-3-hydroxy-1-oxoprop-2-enyl]-5-chlorophenyl]carbamic acid ethyl ester IUPAC Name: ethyl N-[2-[(E)-2-benzoyl-3-ethoxy-3-hydroxyprop-2-enoyl]-5-chlorophenyl]carbamate Traditional Name: N-[2-[(E)-2-benzoyl-3-ethoxy-3-hydroxy-acryloyl]-5-chloro-phenyl]carbamic acid ethyl ester Formula: C21H20ClNO6 MolecularWeight: 417.8396

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=C(C(=O)C1=CC=CC=C1)C(=O)C2=C(C=C(C=C2)Cl)NC(=O)OCC)O

Isomeric SMILES

CCO/C(=C(\C(=O)C1=CC=CC=C1)/C(=O)C2=C(C=C(C=C2)Cl)NC(=O)OCC)/O

InChI

InChI=1S/C21H20ClNO6/c1-3-28-20(26)17(18(24)13-8-6-5-7-9-13)19(25)15-11-10-14(22)12-16(15)23-21(27)29-4-2/h5-12,26H,3-4H2,1-2H3,(H,23,27)/b20-17+