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

Systemtic Name: [5-chloranyl-3-methyl-1-(2-methylpropyl)pyrazol-4-yl]-(3,4-dihydro-1H-isoquinolin-2-yl)methanone Openeye Name: (5-chloro-1-isobutyl-3-methyl-pyrazol-4-yl)-(3,4-dihydro-1H-isoquinolin-2-yl)methanone CAS Name: [5-chloro-3-methyl-1-(2-methylpropyl)-4-pyrazolyl]-(3,4-dihydro-1H-isoquinolin-2-yl)methanone IUPAC Name: [5-chloro-3-methyl-1-(2-methylpropyl)pyrazol-4-yl]-(3,4-dihydro-1H-isoquinolin-2-yl)methanone Traditional Name: (5-chloro-1-isobutyl-3-methyl-pyrazol-4-yl)-(3,4-dihydro-1H-isoquinolin-2-yl)methanone Formula: C18H22ClN3O MolecularWeight: 331.83978

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)N2CCC3=CC=CC=C3C2)Cl)CC(C)C

Isomeric SMILES

CC1=NN(C(=C1C(=O)N2CCC3=CC=CC=C3C2)Cl)CC(C)C

InChI

InChI=1S/C18H22ClN3O/c1-12(2)10-22-17(19)16(13(3)20-22)18(23)21-9-8-14-6-4-5-7-15(14)11-21/h4-7,12H,8-11H2,1-3H3