2-[(E)-3-(4-chlorophenyl)prop-2-enoyl]-N-methyl-3,4-dihydro-1H-isoquinoline-3-carboxamide

Systemtic Name: 2-[(E)-3-(4-chlorophenyl)prop-2-enoyl]-N-methyl-3,4-dihydro-1H-isoquinoline-3-carboxamide Openeye Name: 2-[(E)-3-(4-chlorophenyl)prop-2-enoyl]-N-methyl-3,4-dihydro-1H-isoquinoline-3-carboxamide CAS Name: 2-[(E)-3-(4-chlorophenyl)-1-oxoprop-2-enyl]-N-methyl-3,4-dihydro-1H-isoquinoline-3-carboxamide IUPAC Name: 2-[(E)-3-(4-chlorophenyl)prop-2-enoyl]-N-methyl-3,4-dihydro-1H-isoquinoline-3-carboxamide Traditional Name: 2-[(E)-3-(4-chlorophenyl)acryloyl]-N-methyl-3,4-dihydro-1H-isoquinoline-3-carboxamide Formula: C20H19ClN2O2 MolecularWeight: 354.83006

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1CC2=CC=CC=C2CN1C(=O)C=CC3=CC=C(C=C3)Cl

Isomeric SMILES

CNC(=O)C1CC2=CC=CC=C2CN1C(=O)/C=C/C3=CC=C(C=C3)Cl

InChI

InChI=1S/C20H19ClN2O2/c1-22-20(25)18-12-15-4-2-3-5-16(15)13-23(18)19(24)11-8-14-6-9-17(21)10-7-14/h2-11,18H,12-13H2,1H3,(H,22,25)/b11-8+