5-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)-3-[(3-methylphenyl)methyl]-1,2-dihydroindazol-6-one

Systemtic Name: 5-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)-3-[(3-methylphenyl)methyl]-1,2-dihydroindazol-6-one Openeye Name: 5-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-3-(m-tolylmethyl)-1,2-dihydroindazol-6-one CAS Name: 5-[3,4-dihydro-1H-isoquinolin-2-yl(oxo)methyl]-3-[(3-methylphenyl)methyl]-1,2-dihydroindazol-6-one IUPAC Name: 5-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-3-[(3-methylphenyl)methyl]-1,2-dihydroindazol-6-one Traditional Name: 5-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-3-(3-methylbenzyl)-1,2-dihydroindazol-6-one Formula: C25H23N3O2 MolecularWeight: 397.46902

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CC2=C3C=C(C(=O)C=C3NN2)C(=O)N4CCC5=CC=CC=C5C4

Isomeric SMILES

CC1=CC(=CC=C1)CC2=C3C=C(C(=O)C=C3NN2)C(=O)N4CCC5=CC=CC=C5C4

InChI

InChI=1S/C25H23N3O2/c1-16-5-4-6-17(11-16)12-22-20-13-21(24(29)14-23(20)27-26-22)25(30)28-10-9-18-7-2-3-8-19(18)15-28/h2-8,11,13-14,26-27H,9-10,12,15H2,1H3