2-[3-[3-(diphenylcarbamoyloxy)propyl]-2-methyl-phenyl]pentanoic acid

Systemtic Name: 2-[3-[3-(diphenylcarbamoyloxy)propyl]-2-methyl-phenyl]pentanoic acid Openeye Name: 2-[3-[3-(diphenylcarbamoyloxy)propyl]-2-methyl-phenyl]pentanoic acid CAS Name: 2-[2-methyl-3-[3-[oxo-(N-phenylanilino)methoxy]propyl]phenyl]pentanoic acid IUPAC Name: 2-[3-[3-(diphenylcarbamoyloxy)propyl]-2-methylphenyl]pentanoic acid Traditional Name: 2-[3-[3-(diphenylcarbamoyloxy)propyl]-2-methyl-phenyl]valeric acid Formula: C28H31NO4 MolecularWeight: 445.55004

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1=CC=CC(=C1C)CCCOC(=O)N(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)O

Isomeric SMILES

CCCC(C1=CC=CC(=C1C)CCCOC(=O)N(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C28H31NO4/c1-3-12-26(27(30)31)25-19-10-13-22(21(25)2)14-11-20-33-28(32)29(23-15-6-4-7-16-23)24-17-8-5-9-18-24/h4-10,13,15-19,26H,3,11-12,14,20H2,1-2H3,(H,30,31)