N-[2-[(Z)-2-fluoranyl-3-phenyl-prop-2-enoyl]-3,4-dihydro-1H-isoquinolin-7-yl]-3-methoxy-propanamide

Systemtic Name: N-[2-[(Z)-2-fluoranyl-3-phenyl-prop-2-enoyl]-3,4-dihydro-1H-isoquinolin-7-yl]-3-methoxy-propanamide Openeye Name: N-[2-[(Z)-2-fluoro-3-phenyl-prop-2-enoyl]-3,4-dihydro-1H-isoquinolin-7-yl]-3-methoxy-propanamide CAS Name: N-[2-[(Z)-2-fluoro-1-oxo-3-phenylprop-2-enyl]-3,4-dihydro-1H-isoquinolin-7-yl]-3-methoxypropanamide IUPAC Name: N-[2-[(Z)-2-fluoro-3-phenylprop-2-enoyl]-3,4-dihydro-1H-isoquinolin-7-yl]-3-methoxypropanamide Traditional Name: N-[2-[(Z)-2-fluoro-3-phenyl-acryloyl]-3,4-dihydro-1H-isoquinolin-7-yl]-3-methoxy-propionamide Formula: C22H23FN2O3 MolecularWeight: 382.428023

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Descriptors Computed from Structure

Canonical SMILES:

COCCC(=O)NC1=CC2=C(CCN(C2)C(=O)C(=CC3=CC=CC=C3)F)C=C1

Isomeric SMILES

COCCC(=O)NC1=CC2=C(CCN(C2)C(=O)/C(=C/C3=CC=CC=C3)/F)C=C1

InChI

InChI=1S/C22H23FN2O3/c1-28-12-10-21(26)24-19-8-7-17-9-11-25(15-18(17)14-19)22(27)20(23)13-16-5-3-2-4-6-16/h2-8,13-14H,9-12,15H2,1H3,(H,24,26)/b20-13-