(5-cyclopropyl-2-phenyl-pyrazol-3-yl)-(6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methanone

Systemtic Name: (5-cyclopropyl-2-phenyl-pyrazol-3-yl)-(6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methanone Openeye Name: (5-cyclopropyl-2-phenyl-pyrazol-3-yl)-(6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methanone CAS Name: (5-cyclopropyl-2-phenyl-3-pyrazolyl)-(6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methanone IUPAC Name: (5-cyclopropyl-2-phenylpyrazol-3-yl)-(6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methanone Traditional Name: (5-cyclopropyl-2-phenyl-pyrazol-3-yl)-(6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl)methanone Formula: C26H29N3O3 MolecularWeight: 431.52676

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2CN(CCC2=C1)C(=O)C3=CC(=NN3C4=CC=CC=C4)C5CC5)OCC

Isomeric SMILES

CCOC1=C(C=C2CN(CCC2=C1)C(=O)C3=CC(=NN3C4=CC=CC=C4)C5CC5)OCC

InChI

InChI=1S/C26H29N3O3/c1-3-31-24-14-19-12-13-28(17-20(19)15-25(24)32-4-2)26(30)23-16-22(18-10-11-18)27-29(23)21-8-6-5-7-9-21/h5-9,14-16,18H,3-4,10-13,17H2,1-2H3