2-cyclobutyloxy-4-[4-[2-[(2-oxidanyl-2-phenyl-ethyl)amino]propyl]phenyl]benzoic acid

Systemtic Name: 2-cyclobutyloxy-4-[4-[2-[(2-oxidanyl-2-phenyl-ethyl)amino]propyl]phenyl]benzoic acid Openeye Name: 2-(cyclobutoxy)-4-[4-[2-[(2-hydroxy-2-phenyl-ethyl)amino]propyl]phenyl]benzoic acid CAS Name: 2-cyclobutyloxy-4-[4-[2-[(2-hydroxy-2-phenylethyl)amino]propyl]phenyl]benzoic acid IUPAC Name: 2-cyclobutyloxy-4-[4-[2-[(2-hydroxy-2-phenylethyl)amino]propyl]phenyl]benzoic acid Traditional Name: 2-(cyclobutoxy)-4-[4-[2-[(2-hydroxy-2-phenyl-ethyl)amino]propyl]phenyl]benzoic acid Formula: C28H31NO4 MolecularWeight: 445.55004

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CC=C(C=C1)C2=CC(=C(C=C2)C(=O)O)OC3CCC3)NCC(C4=CC=CC=C4)O

Isomeric SMILES

CC(CC1=CC=C(C=C1)C2=CC(=C(C=C2)C(=O)O)OC3CCC3)NCC(C4=CC=CC=C4)O

InChI

InChI=1S/C28H31NO4/c1-19(29-18-26(30)22-6-3-2-4-7-22)16-20-10-12-21(13-11-20)23-14-15-25(28(31)32)27(17-23)33-24-8-5-9-24/h2-4,6-7,10-15,17,19,24,26,29-30H,5,8-9,16,18H2,1H3,(H,31,32)