3,4,4a,5,6,7-hexahydro-1H-isoquinolin-2-yl-(1-methyl-5-phenyl-pyrazol-4-yl)methanone

Systemtic Name: 3,4,4a,5,6,7-hexahydro-1H-isoquinolin-2-yl-(1-methyl-5-phenyl-pyrazol-4-yl)methanone Openeye Name: 3,4,4a,5,6,7-hexahydro-1H-isoquinolin-2-yl-(1-methyl-5-phenyl-pyrazol-4-yl)methanone CAS Name: 3,4,4a,5,6,7-hexahydro-1H-isoquinolin-2-yl-(1-methyl-5-phenyl-4-pyrazolyl)methanone IUPAC Name: 3,4,4a,5,6,7-hexahydro-1H-isoquinolin-2-yl-(1-methyl-5-phenylpyrazol-4-yl)methanone Traditional Name: 3,4,4a,5,6,7-hexahydro-1H-isoquinolin-2-yl-(1-methyl-5-phenyl-pyrazol-4-yl)methanone Formula: C20H23N3O MolecularWeight: 321.41612

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C=N1)C(=O)N2CCC3CCCC=C3C2)C4=CC=CC=C4

Isomeric SMILES

CN1C(=C(C=N1)C(=O)N2CCC3CCCC=C3C2)C4=CC=CC=C4

InChI

InChI=1S/C20H23N3O/c1-22-19(16-8-3-2-4-9-16)18(13-21-22)20(24)23-12-11-15-7-5-6-10-17(15)14-23/h2-4,8-10,13,15H,5-7,11-12,14H2,1H3