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

Systemtic Name: (3-methoxyphenyl)methyl-[(5S)-1-methyl-3-piperidin-1-ylcarbonyl-4,5,6,7-tetrahydroindazol-5-yl]azanium Openeye Name: (3-methoxyphenyl)methyl-[(5S)-1-methyl-3-(piperidine-1-carbonyl)-4,5,6,7-tetrahydroindazol-5-yl]ammonium CAS Name: (3-methoxyphenyl)methyl-[(5S)-1-methyl-3-[oxo(1-piperidinyl)methyl]-4,5,6,7-tetrahydroindazol-5-yl]ammonium IUPAC Name: (3-methoxyphenyl)methyl-[(5S)-1-methyl-3-(piperidine-1-carbonyl)-4,5,6,7-tetrahydroindazol-5-yl]azanium Traditional Name: m-anisyl-[(5S)-1-methyl-3-(piperidine-1-carbonyl)-4,5,6,7-tetrahydroindazol-5-yl]ammonium Formula: C22H31N4O2+ MolecularWeight: 383.50714

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(CC(CC2)[NH2+]CC3=CC(=CC=C3)OC)C(=N1)C(=O)N4CCCCC4

Isomeric SMILES

CN1C2=C(C[C@H](CC2)[NH2+]CC3=CC(=CC=C3)OC)C(=N1)C(=O)N4CCCCC4

InChI

InChI=1S/C22H30N4O2/c1-25-20-10-9-17(23-15-16-7-6-8-18(13-16)28-2)14-19(20)21(24-25)22(27)26-11-4-3-5-12-26/h6-8,13,17,23H,3-5,9-12,14-15H2,1-2H3/p+1/t17-/m0/s1