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

Systemtic Name: 7-[3-[3-methoxy-4-(2-methylpropanoyl)-2-propyl-phenoxy]propoxy]-8-propyl-3,4-dihydro-2H-chromene-2-carboxylic acid Openeye Name: 7-[3-[3-methoxy-4-(2-methylpropanoyl)-2-propyl-phenoxy]propoxy]-8-propyl-chromane-2-carboxylic acid CAS Name: 7-[3-[3-methoxy-4-(2-methyl-1-oxopropyl)-2-propylphenoxy]propoxy]-8-propyl-3,4-dihydro-2H-1-benzopyran-2-carboxylic acid IUPAC Name: 7-[3-[3-methoxy-4-(2-methylpropanoyl)-2-propylphenoxy]propoxy]-8-propyl-3,4-dihydro-2H-chromene-2-carboxylic acid Traditional Name: 7-[3-(4-isobutyryl-3-methoxy-2-propyl-phenoxy)propoxy]-8-propyl-chroman-2-carboxylic acid Formula: C30H40O7 MolecularWeight: 512.6344

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C30H40O7/c1-6-9-21-24(14-11-20-12-15-26(30(32)33)37-28(20)21)35-17-8-18-36-25-16-13-23(27(31)19(3)4)29(34-5)22(25)10-7-2/h11,13-14,16,19,26H,6-10,12,15,17-18H2,1-5H3,(H,32,33)