3,4-dihydro-1H-isoquinolin-2-yl-[3-(4-ethoxyphenyl)-1H-pyrazol-5-yl]methanone

Systemtic Name: 3,4-dihydro-1H-isoquinolin-2-yl-[3-(4-ethoxyphenyl)-1H-pyrazol-5-yl]methanone Openeye Name: 3,4-dihydro-1H-isoquinolin-2-yl-[3-(4-ethoxyphenyl)-1H-pyrazol-5-yl]methanone CAS Name: 3,4-dihydro-1H-isoquinolin-2-yl-[3-(4-ethoxyphenyl)-1H-pyrazol-5-yl]methanone IUPAC Name: 3,4-dihydro-1H-isoquinolin-2-yl-[3-(4-ethoxyphenyl)-1H-pyrazol-5-yl]methanone Traditional Name: 3,4-dihydro-1H-isoquinolin-2-yl-(3-p-phenetyl-1H-pyrazol-5-yl)methanone Formula: C21H21N3O2 MolecularWeight: 347.41034

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=NNC(=C2)C(=O)N3CCC4=CC=CC=C4C3

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=NNC(=C2)C(=O)N3CCC4=CC=CC=C4C3

InChI

InChI=1S/C21H21N3O2/c1-2-26-18-9-7-16(8-10-18)19-13-20(23-22-19)21(25)24-12-11-15-5-3-4-6-17(15)14-24/h3-10,13H,2,11-12,14H2,1H3,(H,22,23)