1-(1H-indazol-5-yl)-1-(2-phenylpropyl)piperidin-1-ium-4-amine

Systemtic Name: 1-(1H-indazol-5-yl)-1-(2-phenylpropyl)piperidin-1-ium-4-amine Openeye Name: 1-(1H-indazol-5-yl)-1-(2-phenylpropyl)piperidin-1-ium-4-amine CAS Name: 1-(1H-indazol-5-yl)-1-(2-phenylpropyl)-4-piperidin-1-iumamine IUPAC Name: 1-(1H-indazol-5-yl)-1-(2-phenylpropyl)piperidin-1-ium-4-amine Traditional Name: [1-(1H-indazol-5-yl)-1-(2-phenylpropyl)piperidin-1-ium-4-yl]amine Formula: C21H27N4+ MolecularWeight: 335.46588

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C[N+]1(CCC(CC1)N)C2=CC3=C(C=C2)NN=C3)C4=CC=CC=C4

Isomeric SMILES

CC(C[N+]1(CCC(CC1)N)C2=CC3=C(C=C2)NN=C3)C4=CC=CC=C4

InChI

InChI=1S/C21H27N4/c1-16(17-5-3-2-4-6-17)15-25(11-9-19(22)10-12-25)20-7-8-21-18(13-20)14-23-24-21/h2-8,13-14,16,19H,9-12,15,22H2,1H3,(H,23,24)/q+1