16-(2,2-dimethylpropylamino)-2-[(diphenylmethyl)carbamoyl]-16-oxidanylidene-hexadecanoic acid

Systemtic Name: 16-(2,2-dimethylpropylamino)-2-[(diphenylmethyl)carbamoyl]-16-oxidanylidene-hexadecanoic acid Openeye Name: 2-(benzhydrylcarbamoyl)-16-(2,2-dimethylpropylamino)-16-oxo-hexadecanoic acid CAS Name: 16-(2,2-dimethylpropylamino)-2-[[(diphenylmethyl)amino]-oxomethyl]-16-oxohexadecanoic acid IUPAC Name: 2-(benzhydrylcarbamoyl)-16-(2,2-dimethylpropylamino)-16-oxohexadecanoic acid Traditional Name: 2-(benzhydrylcarbamoyl)-16-keto-16-(neopentylamino)palmitic acid Formula: C35H52N2O4 MolecularWeight: 564.79838

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CNC(=O)CCCCCCCCCCCCCC(C(=O)NC(C1=CC=CC=C1)C2=CC=CC=C2)C(=O)O

Isomeric SMILES

CC(C)(C)CNC(=O)CCCCCCCCCCCCCC(C(=O)NC(C1=CC=CC=C1)C2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C35H52N2O4/c1-35(2,3)27-36-31(38)26-20-12-10-8-6-4-5-7-9-11-19-25-30(34(40)41)33(39)37-32(28-21-15-13-16-22-28)29-23-17-14-18-24-29/h13-18,21-24,30,32H,4-12,19-20,25-27H2,1-3H3,(H,36,38)(H,37,39)(H,40,41)