2-(3-methoxyphenyl)ethyl-[(5S)-1-methyl-3-piperidin-1-ylcarbonyl-4,5,6,7-tetrahydroindazol-5-yl]azanium

Systemtic Name: 2-(3-methoxyphenyl)ethyl-[(5S)-1-methyl-3-piperidin-1-ylcarbonyl-4,5,6,7-tetrahydroindazol-5-yl]azanium Openeye Name: 2-(3-methoxyphenyl)ethyl-[(5S)-1-methyl-3-(piperidine-1-carbonyl)-4,5,6,7-tetrahydroindazol-5-yl]ammonium CAS Name: 2-(3-methoxyphenyl)ethyl-[(5S)-1-methyl-3-[oxo(1-piperidinyl)methyl]-4,5,6,7-tetrahydroindazol-5-yl]ammonium IUPAC Name: 2-(3-methoxyphenyl)ethyl-[(5S)-1-methyl-3-(piperidine-1-carbonyl)-4,5,6,7-tetrahydroindazol-5-yl]azanium Traditional Name: 2-(3-methoxyphenyl)ethyl-[(5S)-1-methyl-3-(piperidine-1-carbonyl)-4,5,6,7-tetrahydroindazol-5-yl]ammonium Formula: C23H33N4O2+ MolecularWeight: 397.53372

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(CC(CC2)[NH2+]CCC3=CC(=CC=C3)OC)C(=N1)C(=O)N4CCCCC4

Isomeric SMILES

CN1C2=C(C[C@H](CC2)[NH2+]CCC3=CC(=CC=C3)OC)C(=N1)C(=O)N4CCCCC4

InChI

InChI=1S/C23H32N4O2/c1-26-21-10-9-18(24-12-11-17-7-6-8-19(15-17)29-2)16-20(21)22(25-26)23(28)27-13-4-3-5-14-27/h6-8,15,18,24H,3-5,9-14,16H2,1-2H3/p+1/t18-/m0/s1