N-[4-[(E)-3-(1,3-benzodioxol-5-yl)prop-2-enoyl]phenyl]-2,2-dimethyl-propanamide

Systemtic Name: N-[4-[(E)-3-(1,3-benzodioxol-5-yl)prop-2-enoyl]phenyl]-2,2-dimethyl-propanamide Openeye Name: N-[4-[(E)-3-(1,3-benzodioxol-5-yl)prop-2-enoyl]phenyl]-2,2-dimethyl-propanamide CAS Name: N-[4-[(E)-3-(1,3-benzodioxol-5-yl)-1-oxoprop-2-enyl]phenyl]-2,2-dimethylpropanamide IUPAC Name: N-[4-[(E)-3-(1,3-benzodioxol-5-yl)prop-2-enoyl]phenyl]-2,2-dimethylpropanamide Traditional Name: N-[4-[(E)-3-(1,3-benzodioxol-5-yl)acryloyl]phenyl]-2,2-dimethyl-propionamide Formula: C21H21NO4 MolecularWeight: 351.39574

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)NC1=CC=C(C=C1)C(=O)C=CC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CC(C)(C)C(=O)NC1=CC=C(C=C1)C(=O)/C=C/C2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C21H21NO4/c1-21(2,3)20(24)22-16-8-6-15(7-9-16)17(23)10-4-14-5-11-18-19(12-14)26-13-25-18/h4-12H,13H2,1-3H3,(H,22,24)/b10-4+