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

Systemtic Name: (5-chloranyl-3-methyl-1-phenyl-pyrazol-4-yl)-(3,4-dihydro-1H-isoquinolin-2-yl)methanone Openeye Name: (5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)-(3,4-dihydro-1H-isoquinolin-2-yl)methanone CAS Name: (5-chloro-3-methyl-1-phenyl-4-pyrazolyl)-(3,4-dihydro-1H-isoquinolin-2-yl)methanone IUPAC Name: (5-chloro-3-methyl-1-phenylpyrazol-4-yl)-(3,4-dihydro-1H-isoquinolin-2-yl)methanone Traditional Name: (5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)-(3,4-dihydro-1H-isoquinolin-2-yl)methanone Formula: C20H18ClN3O MolecularWeight: 351.82942

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)N2CCC3=CC=CC=C3C2)Cl)C4=CC=CC=C4

Isomeric SMILES

CC1=NN(C(=C1C(=O)N2CCC3=CC=CC=C3C2)Cl)C4=CC=CC=C4

InChI

InChI=1S/C20H18ClN3O/c1-14-18(19(21)24(22-14)17-9-3-2-4-10-17)20(25)23-12-11-15-7-5-6-8-16(15)13-23/h2-10H,11-13H2,1H3