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

Systemtic Name: (4-tert-butylphenyl)methyl-[2-[(1-ethoxycarbonylpiperidin-4-yl)amino]-2-oxidanylidene-ethyl]-methyl-azanium Openeye Name: (4-tert-butylphenyl)methyl-[2-[(1-ethoxycarbonyl-4-piperidyl)amino]-2-oxo-ethyl]-methyl-ammonium CAS Name: (4-tert-butylphenyl)methyl-[2-[(1-ethoxycarbonyl-4-piperidinyl)amino]-2-oxoethyl]-methylammonium IUPAC Name: (4-tert-butylphenyl)methyl-[2-[(1-ethoxycarbonylpiperidin-4-yl)amino]-2-oxoethyl]-methylazanium Traditional Name: (4-tert-butylbenzyl)-[2-[(1-carbethoxy-4-piperidyl)amino]-2-keto-ethyl]-methyl-ammonium Formula: C22H36N3O3+ MolecularWeight: 390.53954

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)NC(=O)C[NH+](C)CC2=CC=C(C=C2)C(C)(C)C

Isomeric SMILES

CCOC(=O)N1CCC(CC1)NC(=O)C[NH+](C)CC2=CC=C(C=C2)C(C)(C)C

InChI

InChI=1S/C22H35N3O3/c1-6-28-21(27)25-13-11-19(12-14-25)23-20(26)16-24(5)15-17-7-9-18(10-8-17)22(2,3)4/h7-10,19H,6,11-16H2,1-5H3,(H,23,26)/p+1