3-[4-[3-[(4-butylphenyl)carbamoylamino]propoxy]phenyl]-2-methyl-2-phenoxy-propanoic acid

Systemtic Name: 3-[4-[3-[(4-butylphenyl)carbamoylamino]propoxy]phenyl]-2-methyl-2-phenoxy-propanoic acid Openeye Name: 3-[4-[3-[(4-butylphenyl)carbamoylamino]propoxy]phenyl]-2-methyl-2-phenoxy-propanoic acid CAS Name: 3-[4-[3-[[(4-butylanilino)-oxomethyl]amino]propoxy]phenyl]-2-methyl-2-phenoxypropanoic acid IUPAC Name: 3-[4-[3-[(4-butylphenyl)carbamoylamino]propoxy]phenyl]-2-methyl-2-phenoxypropanoic acid Traditional Name: 3-[4-[3-[(4-butylphenyl)carbamoylamino]propoxy]phenyl]-2-methyl-2-phenoxy-propionic acid Formula: C30H36N2O5 MolecularWeight: 504.61724

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=O)NCCCOC2=CC=C(C=C2)CC(C)(C(=O)O)OC3=CC=CC=C3

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=O)NCCCOC2=CC=C(C=C2)CC(C)(C(=O)O)OC3=CC=CC=C3

InChI

InChI=1S/C30H36N2O5/c1-3-4-9-23-12-16-25(17-13-23)32-29(35)31-20-8-21-36-26-18-14-24(15-19-26)22-30(2,28(33)34)37-27-10-6-5-7-11-27/h5-7,10-19H,3-4,8-9,20-22H2,1-2H3,(H,33,34)(H2,31,32,35)