methyl 2,2,6,6-tetramethyl-1-[(4-methylphenyl)methyl]-4-(octadecylcarbamoylamino)piperidine-4-carboxylate

Systemtic Name: methyl 2,2,6,6-tetramethyl-1-[(4-methylphenyl)methyl]-4-(octadecylcarbamoylamino)piperidine-4-carboxylate Openeye Name: methyl 2,2,6,6-tetramethyl-4-(octadecylcarbamoylamino)-1-(p-tolylmethyl)piperidine-4-carboxylate CAS Name: 2,2,6,6-tetramethyl-1-[(4-methylphenyl)methyl]-4-[[(octadecylamino)-oxomethyl]amino]-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 2,2,6,6-tetramethyl-1-[(4-methylphenyl)methyl]-4-(octadecylcarbamoylamino)piperidine-4-carboxylate Traditional Name: 2,2,6,6-tetramethyl-1-(4-methylbenzyl)-4-(stearylcarbamoylamino)isonipecotic acid methyl ester Formula: C38H67N3O3 MolecularWeight: 613.95688

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCNC(=O)NC1(CC(N(C(C1)(C)C)CC2=CC=C(C=C2)C)(C)C)C(=O)OC

Isomeric SMILES

CCCCCCCCCCCCCCCCCCNC(=O)NC1(CC(N(C(C1)(C)C)CC2=CC=C(C=C2)C)(C)C)C(=O)OC

InChI

InChI=1S/C38H67N3O3/c1-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-28-39-35(43)40-38(34(42)44-7)30-36(3,4)41(37(5,6)31-38)29-33-26-24-32(2)25-27-33/h24-27H,8-23,28-31H2,1-7H3,(H2,39,40,43)