2-[5-butyl-5-[4-(4-phenoxy-2-propyl-phenoxy)butylamino]cyclohexa-1,3-dien-1-yl]ethanoic acid

Systemtic Name: 2-[5-butyl-5-[4-(4-phenoxy-2-propyl-phenoxy)butylamino]cyclohexa-1,3-dien-1-yl]ethanoic acid Openeye Name: 2-[5-butyl-5-[4-(4-phenoxy-2-propyl-phenoxy)butylamino]cyclohexa-1,3-dien-1-yl]acetic acid CAS Name: 2-[5-butyl-5-[4-(4-phenoxy-2-propylphenoxy)butylamino]-1-cyclohexa-1,3-dienyl]acetic acid IUPAC Name: 2-[5-butyl-5-[4-(4-phenoxy-2-propylphenoxy)butylamino]cyclohexa-1,3-dien-1-yl]acetic acid Traditional Name: 2-[5-butyl-5-[4-(4-phenoxy-2-propyl-phenoxy)butylamino]cyclohexa-1,3-dien-1-yl]acetic acid Formula: C31H41NO4 MolecularWeight: 491.66154

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1(CC(=CC=C1)CC(=O)O)NCCCCOC2=C(C=C(C=C2)OC3=CC=CC=C3)CCC

Isomeric SMILES

CCCCC1(CC(=CC=C1)CC(=O)O)NCCCCOC2=C(C=C(C=C2)OC3=CC=CC=C3)CCC

InChI

InChI=1S/C31H41NO4/c1-3-5-18-31(19-11-13-25(24-31)22-30(33)34)32-20-9-10-21-35-29-17-16-28(23-26(29)12-4-2)36-27-14-7-6-8-15-27/h6-8,11,13-17,19,23,32H,3-5,9-10,12,18,20-22,24H2,1-2H3,(H,33,34)