tert-butyl 4-(2-methylquinolin-1-ium-4-yl)piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-(2-methylquinolin-1-ium-4-yl)piperazine-1-carboxylate Openeye Name: tert-butyl 4-(2-methylquinolin-1-ium-4-yl)piperazine-1-carboxylate CAS Name: 4-(2-methyl-4-quinolin-1-iumyl)-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(2-methylquinolin-1-ium-4-yl)piperazine-1-carboxylate Traditional Name: 4-(2-methylquinolin-1-ium-4-yl)piperazine-1-carboxylic acid tert-butyl ester Formula: C19H26N3O2+ MolecularWeight: 328.42864

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[NH+]C2=CC=CC=C2C(=C1)N3CCN(CC3)C(=O)OC(C)(C)C

Isomeric SMILES

CC1=[NH+]C2=CC=CC=C2C(=C1)N3CCN(CC3)C(=O)OC(C)(C)C

InChI

InChI=1S/C19H25N3O2/c1-14-13-17(15-7-5-6-8-16(15)20-14)21-9-11-22(12-10-21)18(23)24-19(2,3)4/h5-8,13H,9-12H2,1-4H3/p+1