2-[4-[4-[(6-butoxynaphthalen-2-yl)carbonylamino]phenyl]phenoxy]-3-phenyl-propanoic acid

Systemtic Name: 2-[4-[4-[(6-butoxynaphthalen-2-yl)carbonylamino]phenyl]phenoxy]-3-phenyl-propanoic acid Openeye Name: 2-[4-[4-[(6-butoxynaphthalene-2-carbonyl)amino]phenyl]phenoxy]-3-phenyl-propanoic acid CAS Name: 2-[4-[4-[[(6-butoxy-2-naphthalenyl)-oxomethyl]amino]phenyl]phenoxy]-3-phenylpropanoic acid IUPAC Name: 2-[4-[4-[(6-butoxynaphthalene-2-carbonyl)amino]phenyl]phenoxy]-3-phenylpropanoic acid Traditional Name: 2-[4-[4-[(6-butoxy-2-naphthoyl)amino]phenyl]phenoxy]-3-phenyl-propionic acid Formula: C36H33NO5 MolecularWeight: 559.65092

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC2=C(C=C1)C=C(C=C2)C(=O)NC3=CC=C(C=C3)C4=CC=C(C=C4)OC(CC5=CC=CC=C5)C(=O)O

Isomeric SMILES

CCCCOC1=CC2=C(C=C1)C=C(C=C2)C(=O)NC3=CC=C(C=C3)C4=CC=C(C=C4)OC(CC5=CC=CC=C5)C(=O)O

InChI

InChI=1S/C36H33NO5/c1-2-3-21-41-33-20-15-28-23-30(10-9-29(28)24-33)35(38)37-31-16-11-26(12-17-31)27-13-18-32(19-14-27)42-34(36(39)40)22-25-7-5-4-6-8-25/h4-20,23-24,34H,2-3,21-22H2,1H3,(H,37,38)(H,39,40)