3-[2-(cyclopentylmethoxy)-3-[6-(dimethylamino)naphthalen-2-yl]phenyl]propanoic acid

Systemtic Name: 3-[2-(cyclopentylmethoxy)-3-[6-(dimethylamino)naphthalen-2-yl]phenyl]propanoic acid Openeye Name: 3-[2-(cyclopentylmethoxy)-3-[6-(dimethylamino)-2-naphthyl]phenyl]propanoic acid CAS Name: 3-[2-(cyclopentylmethoxy)-3-[6-(dimethylamino)-2-naphthalenyl]phenyl]propanoic acid IUPAC Name: 3-[2-(cyclopentylmethoxy)-3-[6-(dimethylamino)naphthalen-2-yl]phenyl]propanoic acid Traditional Name: 3-[2-(cyclopentylmethoxy)-3-[6-(dimethylamino)-2-naphthyl]phenyl]propionic acid Formula: C27H31NO3 MolecularWeight: 417.53994

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC2=C(C=C1)C=C(C=C2)C3=C(C(=CC=C3)CCC(=O)O)OCC4CCCC4

Isomeric SMILES

CN(C)C1=CC2=C(C=C1)C=C(C=C2)C3=C(C(=CC=C3)CCC(=O)O)OCC4CCCC4

InChI

InChI=1S/C27H31NO3/c1-28(2)24-14-12-21-16-23(11-10-22(21)17-24)25-9-5-8-20(13-15-26(29)30)27(25)31-18-19-6-3-4-7-19/h5,8-12,14,16-17,19H,3-4,6-7,13,15,18H2,1-2H3,(H,29,30)