N-tert-butyl-2-[(E)-3-phenylprop-2-enoyl]-3,4-dihydro-1H-isoquinoline-1-carboxamide

Systemtic Name: N-tert-butyl-2-[(E)-3-phenylprop-2-enoyl]-3,4-dihydro-1H-isoquinoline-1-carboxamide Openeye Name: N-tert-butyl-2-[(E)-3-phenylprop-2-enoyl]-3,4-dihydro-1H-isoquinoline-1-carboxamide CAS Name: N-tert-butyl-2-[(E)-1-oxo-3-phenylprop-2-enyl]-3,4-dihydro-1H-isoquinoline-1-carboxamide IUPAC Name: N-tert-butyl-2-[(E)-3-phenylprop-2-enoyl]-3,4-dihydro-1H-isoquinoline-1-carboxamide Traditional Name: N-tert-butyl-2-[(E)-3-phenylacryloyl]-3,4-dihydro-1H-isoquinoline-1-carboxamide Formula: C23H26N2O2 MolecularWeight: 362.46474

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)C1C2=CC=CC=C2CCN1C(=O)C=CC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)NC(=O)C1C2=CC=CC=C2CCN1C(=O)/C=C/C3=CC=CC=C3

InChI

InChI=1S/C23H26N2O2/c1-23(2,3)24-22(27)21-19-12-8-7-11-18(19)15-16-25(21)20(26)14-13-17-9-5-4-6-10-17/h4-14,21H,15-16H2,1-3H3,(H,24,27)/b14-13+