cyclohexylmethyl-[(5R)-3-(dimethylcarbamoyl)-1-propyl-4,5,6,7-tetrahydroindazol-5-yl]azanium

Systemtic Name: cyclohexylmethyl-[(5R)-3-(dimethylcarbamoyl)-1-propyl-4,5,6,7-tetrahydroindazol-5-yl]azanium Openeye Name: cyclohexylmethyl-[(5R)-3-(dimethylcarbamoyl)-1-propyl-4,5,6,7-tetrahydroindazol-5-yl]ammonium CAS Name: cyclohexylmethyl-[(5R)-3-[dimethylamino(oxo)methyl]-1-propyl-4,5,6,7-tetrahydroindazol-5-yl]ammonium IUPAC Name: cyclohexylmethyl-[(5R)-3-(dimethylcarbamoyl)-1-propyl-4,5,6,7-tetrahydroindazol-5-yl]azanium Traditional Name: cyclohexylmethyl-[(5R)-3-(dimethylcarbamoyl)-1-propyl-4,5,6,7-tetrahydroindazol-5-yl]ammonium Formula: C20H35N4O+ MolecularWeight: 347.5181

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(CC(CC2)[NH2+]CC3CCCCC3)C(=N1)C(=O)N(C)C

Isomeric SMILES

CCCN1C2=C(C[C@@H](CC2)[NH2+]CC3CCCCC3)C(=N1)C(=O)N(C)C

InChI

InChI=1S/C20H34N4O/c1-4-12-24-18-11-10-16(21-14-15-8-6-5-7-9-15)13-17(18)19(22-24)20(25)23(2)3/h15-16,21H,4-14H2,1-3H3/p+1/t16-/m1/s1