tert-butyl 4-(furo[3,2-c]quinolin-2-ylmethyl)piperazin-4-ium-1-carboxylate

Systemtic Name: tert-butyl 4-(furo[3,2-c]quinolin-2-ylmethyl)piperazin-4-ium-1-carboxylate Openeye Name: tert-butyl 4-(furo[3,2-c]quinolin-2-ylmethyl)piperazin-4-ium-1-carboxylate CAS Name: 4-(2-furo[3,2-c]quinolinylmethyl)-1-piperazin-4-iumcarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(furo[3,2-c]quinolin-2-ylmethyl)piperazin-4-ium-1-carboxylate Traditional Name: 4-(furo[3,2-c]quinolin-2-ylmethyl)piperazin-4-ium-1-carboxylic acid tert-butyl ester Formula: C21H26N3O3+ MolecularWeight: 368.44944

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CC[NH+](CC1)CC2=CC3=C(O2)C4=CC=CC=C4N=C3

Isomeric SMILES

CC(C)(C)OC(=O)N1CC[NH+](CC1)CC2=CC3=C(O2)C4=CC=CC=C4N=C3

InChI

InChI=1S/C21H25N3O3/c1-21(2,3)27-20(25)24-10-8-23(9-11-24)14-16-12-15-13-22-18-7-5-4-6-17(18)19(15)26-16/h4-7,12-13H,8-11,14H2,1-3H3/p+1