dimethyl-[(5S)-3-(methylcarbamoyl)-1-phenethyl-4,5,6,7-tetrahydroindazol-5-yl]azanium

Systemtic Name: dimethyl-[(5S)-3-(methylcarbamoyl)-1-phenethyl-4,5,6,7-tetrahydroindazol-5-yl]azanium Openeye Name: dimethyl-[(5S)-3-(methylcarbamoyl)-1-phenethyl-4,5,6,7-tetrahydroindazol-5-yl]ammonium CAS Name: dimethyl-[(5S)-3-(methylcarbamoyl)-1-phenethyl-4,5,6,7-tetrahydroindazol-5-yl]ammonium IUPAC Name: dimethyl-[(5S)-3-(methylcarbamoyl)-1-phenethyl-4,5,6,7-tetrahydroindazol-5-yl]azanium Traditional Name: dimethyl-[(5S)-3-(methylcarbamoyl)-1-phenethyl-4,5,6,7-tetrahydroindazol-5-yl]ammonium Formula: C19H27N4O+ MolecularWeight: 327.44388

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=NN(C2=C1CC(CC2)[NH+](C)C)CCC3=CC=CC=C3

Isomeric SMILES

CNC(=O)C1=NN(C2=C1C[C@H](CC2)[NH+](C)C)CCC3=CC=CC=C3

InChI

InChI=1S/C19H26N4O/c1-20-19(24)18-16-13-15(22(2)3)9-10-17(16)23(21-18)12-11-14-7-5-4-6-8-14/h4-8,15H,9-13H2,1-3H3,(H,20,24)/p+1/t15-/m0/s1