1-(6-decoxynaphthalen-2-yl)-6-[(2S)-2-methylbutoxy]naphthalene-2-carboxylic acid

Systemtic Name: 1-(6-decoxynaphthalen-2-yl)-6-[(2S)-2-methylbutoxy]naphthalene-2-carboxylic acid Openeye Name: 1-(6-decoxy-2-naphthyl)-6-[(2S)-2-methylbutoxy]naphthalene-2-carboxylic acid CAS Name: 1-(6-decoxy-2-naphthalenyl)-6-[(2S)-2-methylbutoxy]-2-naphthalenecarboxylic acid IUPAC Name: 1-(6-decoxynaphthalen-2-yl)-6-[(2S)-2-methylbutoxy]naphthalene-2-carboxylic acid Traditional Name: 1-(6-decoxy-2-naphthyl)-6-[(2S)-2-methylbutoxy]-2-naphthoic acid Formula: C36H44O4 MolecularWeight: 540.73216

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC1=CC2=C(C=C1)C=C(C=C2)C3=C(C=CC4=C3C=CC(=C4)OCC(C)CC)C(=O)O

Isomeric SMILES

CCCCCCCCCCOC1=CC2=C(C=C1)C=C(C=C2)C3=C(C=CC4=C3C=CC(=C4)OC[C@@H](C)CC)C(=O)O

InChI

InChI=1S/C36H44O4/c1-4-6-7-8-9-10-11-12-21-39-31-17-15-27-22-30(14-13-28(27)23-31)35-33-20-18-32(40-25-26(3)5-2)24-29(33)16-19-34(35)36(37)38/h13-20,22-24,26H,4-12,21,25H2,1-3H3,(H,37,38)/t26-/m0/s1