cyclopropyl-[(5R)-3-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)-1-methyl-4,5,6,7-tetrahydroindazol-5-yl]azanium

Systemtic Name: cyclopropyl-[(5R)-3-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)-1-methyl-4,5,6,7-tetrahydroindazol-5-yl]azanium Openeye Name: cyclopropyl-[(5R)-3-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-1-methyl-4,5,6,7-tetrahydroindazol-5-yl]ammonium CAS Name: cyclopropyl-[(5R)-3-[3,4-dihydro-1H-isoquinolin-2-yl(oxo)methyl]-1-methyl-4,5,6,7-tetrahydroindazol-5-yl]ammonium IUPAC Name: cyclopropyl-[(5R)-3-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-1-methyl-4,5,6,7-tetrahydroindazol-5-yl]azanium Traditional Name: cyclopropyl-[(5R)-3-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-1-methyl-4,5,6,7-tetrahydroindazol-5-yl]ammonium Formula: C21H27N4O+ MolecularWeight: 351.46528

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(CC(CC2)[NH2+]C3CC3)C(=N1)C(=O)N4CCC5=CC=CC=C5C4

Isomeric SMILES

CN1C2=C(C[C@@H](CC2)[NH2+]C3CC3)C(=N1)C(=O)N4CCC5=CC=CC=C5C4

InChI

InChI=1S/C21H26N4O/c1-24-19-9-8-17(22-16-6-7-16)12-18(19)20(23-24)21(26)25-11-10-14-4-2-3-5-15(14)13-25/h2-5,16-17,22H,6-13H2,1H3/p+1/t17-/m1/s1