(Z)-3-(6-chloranyl-1,3-benzodioxol-5-yl)-2-cyano-N-[(1S)-1-phenylethyl]prop-2-enamide

Systemtic Name: (Z)-3-(6-chloranyl-1,3-benzodioxol-5-yl)-2-cyano-N-[(1S)-1-phenylethyl]prop-2-enamide Openeye Name: (Z)-3-(6-chloro-1,3-benzodioxol-5-yl)-2-cyano-N-[(1S)-1-phenylethyl]prop-2-enamide CAS Name: (Z)-3-(6-chloro-1,3-benzodioxol-5-yl)-2-cyano-N-[(1S)-1-phenylethyl]-2-propenamide IUPAC Name: (Z)-3-(6-chloro-1,3-benzodioxol-5-yl)-2-cyano-N-[(1S)-1-phenylethyl]prop-2-enamide Traditional Name: (Z)-3-(6-chloro-1,3-benzodioxol-5-yl)-2-cyano-N-[(1S)-1-phenylethyl]acrylamide Formula: C19H15ClN2O3 MolecularWeight: 354.787

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC(=O)C(=CC2=CC3=C(C=C2Cl)OCO3)C#N

Isomeric SMILES

C[C@@H](C1=CC=CC=C1)NC(=O)/C(=C\C2=CC3=C(C=C2Cl)OCO3)/C#N

InChI

InChI=1S/C19H15ClN2O3/c1-12(13-5-3-2-4-6-13)22-19(23)15(10-21)7-14-8-17-18(9-16(14)20)25-11-24-17/h2-9,12H,11H2,1H3,(H,22,23)/b15-7-/t12-/m0/s1