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

Systemtic Name: 7-[3-[3-methoxy-4-(methylcarbamoyl)-2-prop-2-enyl-phenoxy]propoxy]-8-propyl-3,4-dihydro-2H-chromene-2-carboxylic acid Openeye Name: 7-[3-[2-allyl-3-methoxy-4-(methylcarbamoyl)phenoxy]propoxy]-8-propyl-chromane-2-carboxylic acid CAS Name: 7-[3-[3-methoxy-4-(methylcarbamoyl)-2-prop-2-enylphenoxy]propoxy]-8-propyl-3,4-dihydro-2H-1-benzopyran-2-carboxylic acid IUPAC Name: 7-[3-[3-methoxy-4-(methylcarbamoyl)-2-prop-2-enylphenoxy]propoxy]-8-propyl-3,4-dihydro-2H-chromene-2-carboxylic acid Traditional Name: 7-[3-[2-allyl-3-methoxy-4-(methylcarbamoyl)phenoxy]propoxy]-8-propyl-chroman-2-carboxylic acid Formula: C28H35NO7 MolecularWeight: 497.58

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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)NC)OC)CC=C

Isomeric SMILES

CCCC1=C(C=CC2=C1OC(CC2)C(=O)O)OCCCOC3=C(C(=C(C=C3)C(=O)NC)OC)CC=C

InChI

InChI=1S/C28H35NO7/c1-5-8-19-22(13-10-18-11-14-24(28(31)32)36-25(18)19)34-16-7-17-35-23-15-12-21(27(30)29-3)26(33-4)20(23)9-6-2/h6,10,12-13,15,24H,2,5,7-9,11,14,16-17H2,1,3-4H3,(H,29,30)(H,31,32)