7-[3-(4-ethanoyl-3-methoxy-2-propyl-phenoxy)propoxy]-8-propyl-2H-chromene-2-carboxylic acid

Systemtic Name: 7-[3-(4-ethanoyl-3-methoxy-2-propyl-phenoxy)propoxy]-8-propyl-2H-chromene-2-carboxylic acid Openeye Name: 7-[3-(4-acetyl-3-methoxy-2-propyl-phenoxy)propoxy]-8-propyl-2H-chromene-2-carboxylic acid CAS Name: 7-[3-(4-acetyl-3-methoxy-2-propylphenoxy)propoxy]-8-propyl-2H-1-benzopyran-2-carboxylic acid IUPAC Name: 7-[3-(4-acetyl-3-methoxy-2-propylphenoxy)propoxy]-8-propyl-2H-chromene-2-carboxylic acid Traditional Name: 7-[3-(4-acetyl-3-methoxy-2-propyl-phenoxy)propoxy]-8-propyl-2H-chromene-2-carboxylic acid Formula: C28H34O7 MolecularWeight: 482.56536

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC2=C1OC(C=C2)C(=O)O)OCCCOC3=C(C(=C(C=C3)C(=O)C)OC)CCC

Isomeric SMILES

CCCC1=C(C=CC2=C1OC(C=C2)C(=O)O)OCCCOC3=C(C(=C(C=C3)C(=O)C)OC)CCC

InChI

InChI=1S/C28H34O7/c1-5-8-21-23(13-10-19-11-14-25(28(30)31)35-26(19)21)33-16-7-17-34-24-15-12-20(18(3)29)27(32-4)22(24)9-6-2/h10-15,25H,5-9,16-17H2,1-4H3,(H,30,31)