(4-tert-butylphenyl)methyl-[2-(4-methoxycarbonylpiperidin-1-yl)-2-oxidanylidene-ethyl]-methyl-azanium

Systemtic Name: (4-tert-butylphenyl)methyl-[2-(4-methoxycarbonylpiperidin-1-yl)-2-oxidanylidene-ethyl]-methyl-azanium Openeye Name: (4-tert-butylphenyl)methyl-[2-(4-methoxycarbonyl-1-piperidyl)-2-oxo-ethyl]-methyl-ammonium CAS Name: (4-tert-butylphenyl)methyl-[2-(4-methoxycarbonyl-1-piperidinyl)-2-oxoethyl]-methylammonium IUPAC Name: (4-tert-butylphenyl)methyl-[2-(4-methoxycarbonylpiperidin-1-yl)-2-oxoethyl]-methylazanium Traditional Name: (4-tert-butylbenzyl)-[2-(4-carbomethoxypiperidino)-2-keto-ethyl]-methyl-ammonium Formula: C21H33N2O3+ MolecularWeight: 361.49832

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C[NH+](C)CC(=O)N2CCC(CC2)C(=O)OC

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C[NH+](C)CC(=O)N2CCC(CC2)C(=O)OC

InChI

InChI=1S/C21H32N2O3/c1-21(2,3)18-8-6-16(7-9-18)14-22(4)15-19(24)23-12-10-17(11-13-23)20(25)26-5/h6-9,17H,10-15H2,1-5H3/p+1