4-[[7-(2-ethylbutylcarbamoyl)naphthalen-1-yl]methyl]-3-methoxy-benzoic acid

Systemtic Name: 4-[[7-(2-ethylbutylcarbamoyl)naphthalen-1-yl]methyl]-3-methoxy-benzoic acid Openeye Name: 4-[[7-(2-ethylbutylcarbamoyl)-1-naphthyl]methyl]-3-methoxy-benzoic acid CAS Name: 4-[[7-[(2-ethylbutylamino)-oxomethyl]-1-naphthalenyl]methyl]-3-methoxybenzoic acid IUPAC Name: 4-[[7-(2-ethylbutylcarbamoyl)naphthalen-1-yl]methyl]-3-methoxybenzoic acid Traditional Name: 4-[[7-(2-ethylbutylcarbamoyl)-1-naphthyl]methyl]-3-methoxy-benzoic acid Formula: C26H29NO4 MolecularWeight: 419.51276

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)CNC(=O)C1=CC2=C(C=CC=C2CC3=C(C=C(C=C3)C(=O)O)OC)C=C1

Isomeric SMILES

CCC(CC)CNC(=O)C1=CC2=C(C=CC=C2CC3=C(C=C(C=C3)C(=O)O)OC)C=C1

InChI

InChI=1S/C26H29NO4/c1-4-17(5-2)16-27-25(28)21-11-9-18-7-6-8-19(23(18)14-21)13-20-10-12-22(26(29)30)15-24(20)31-3/h6-12,14-15,17H,4-5,13,16H2,1-3H3,(H,27,28)(H,29,30)