diethyl-[(3S)-1-[[5-(indol-1-ylmethyl)-1H-pyrazol-3-yl]carbonyl]pyrrolidin-3-yl]azanium

Systemtic Name: diethyl-[(3S)-1-[[5-(indol-1-ylmethyl)-1H-pyrazol-3-yl]carbonyl]pyrrolidin-3-yl]azanium Openeye Name: diethyl-[(3S)-1-[5-(indol-1-ylmethyl)-1H-pyrazole-3-carbonyl]pyrrolidin-3-yl]ammonium CAS Name: diethyl-[(3S)-1-[[5-(1-indolylmethyl)-1H-pyrazol-3-yl]-oxomethyl]-3-pyrrolidinyl]ammonium IUPAC Name: diethyl-[(3S)-1-[5-(indol-1-ylmethyl)-1H-pyrazole-3-carbonyl]pyrrolidin-3-yl]azanium Traditional Name: diethyl-[(3S)-1-[5-(indol-1-ylmethyl)-1H-pyrazole-3-carbonyl]pyrrolidin-3-yl]ammonium Formula: C21H28N5O+ MolecularWeight: 366.47992

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)C1CCN(C1)C(=O)C2=NNC(=C2)CN3C=CC4=CC=CC=C43

Isomeric SMILES

CC[NH+](CC)[C@H]1CCN(C1)C(=O)C2=NNC(=C2)CN3C=CC4=CC=CC=C43

InChI

InChI=1S/C21H27N5O/c1-3-24(4-2)18-10-12-26(15-18)21(27)19-13-17(22-23-19)14-25-11-9-16-7-5-6-8-20(16)25/h5-9,11,13,18H,3-4,10,12,14-15H2,1-2H3,(H,22,23)/p+1/t18-/m0/s1