3-[2,2-dimethylpropyl-[(diphenylmethyl)carbamoyl]carbamoyl]tridecanoic acid

Systemtic Name: 3-[2,2-dimethylpropyl-[(diphenylmethyl)carbamoyl]carbamoyl]tridecanoic acid Openeye Name: 3-[benzhydrylcarbamoyl(2,2-dimethylpropyl)carbamoyl]tridecanoic acid CAS Name: 3-[[2,2-dimethylpropyl-[[(diphenylmethyl)amino]-oxomethyl]amino]-oxomethyl]tridecanoic acid IUPAC Name: 3-[benzhydrylcarbamoyl(2,2-dimethylpropyl)carbamoyl]tridecanoic acid Traditional Name: 3-[benzhydrylcarbamoyl(neopentyl)carbamoyl]tridecanoic acid Formula: C33H48N2O4 MolecularWeight: 536.74522

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC(CC(=O)O)C(=O)N(CC(C)(C)C)C(=O)NC(C1=CC=CC=C1)C2=CC=CC=C2

Isomeric SMILES

CCCCCCCCCCC(CC(=O)O)C(=O)N(CC(C)(C)C)C(=O)NC(C1=CC=CC=C1)C2=CC=CC=C2

InChI

InChI=1S/C33H48N2O4/c1-5-6-7-8-9-10-11-14-23-28(24-29(36)37)31(38)35(25-33(2,3)4)32(39)34-30(26-19-15-12-16-20-26)27-21-17-13-18-22-27/h12-13,15-22,28,30H,5-11,14,23-25H2,1-4H3,(H,34,39)(H,36,37)