butan-2-yl 3-[4-[4-(4-chlorophenyl)phenoxy]phenyl]-4-phenyl-butanoate

Systemtic Name: butan-2-yl 3-[4-[4-(4-chlorophenyl)phenoxy]phenyl]-4-phenyl-butanoate Openeye Name: sec-butyl 3-[4-[4-(4-chlorophenyl)phenoxy]phenyl]-4-phenyl-butanoate CAS Name: 3-[4-[4-(4-chlorophenyl)phenoxy]phenyl]-4-phenylbutanoic acid butan-2-yl ester IUPAC Name: butan-2-yl 3-[4-[4-(4-chlorophenyl)phenoxy]phenyl]-4-phenylbutanoate Traditional Name: 3-[4-[4-(4-chlorophenyl)phenoxy]phenyl]-4-phenyl-butyric acid sec-butyl ester Formula: C32H31ClO3 MolecularWeight: 499.03974

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)OC(=O)CC(CC1=CC=CC=C1)C2=CC=C(C=C2)OC3=CC=C(C=C3)C4=CC=C(C=C4)Cl

Isomeric SMILES

CCC(C)OC(=O)CC(CC1=CC=CC=C1)C2=CC=C(C=C2)OC3=CC=C(C=C3)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C32H31ClO3/c1-3-23(2)35-32(34)22-28(21-24-7-5-4-6-8-24)27-13-19-31(20-14-27)36-30-17-11-26(12-18-30)25-9-15-29(33)16-10-25/h4-20,23,28H,3,21-22H2,1-2H3