3-[7-[3-(4-aminocarbonyl-3-methoxy-2-prop-2-enyl-phenoxy)propoxy]-8-propyl-3,4-dihydro-2H-chromen-2-yl]propanoic acid

Systemtic Name: 3-[7-[3-(4-aminocarbonyl-3-methoxy-2-prop-2-enyl-phenoxy)propoxy]-8-propyl-3,4-dihydro-2H-chromen-2-yl]propanoic acid Openeye Name: 3-[7-[3-(2-allyl-4-carbamoyl-3-methoxy-phenoxy)propoxy]-8-propyl-chroman-2-yl]propanoic acid CAS Name: 3-[7-[3-(4-carbamoyl-3-methoxy-2-prop-2-enylphenoxy)propoxy]-8-propyl-3,4-dihydro-2H-1-benzopyran-2-yl]propanoic acid IUPAC Name: 3-[7-[3-(4-carbamoyl-3-methoxy-2-prop-2-enylphenoxy)propoxy]-8-propyl-3,4-dihydro-2H-chromen-2-yl]propanoic acid Traditional Name: 3-[7-[3-(2-allyl-4-carbamoyl-3-methoxy-phenoxy)propoxy]-8-propyl-chroman-2-yl]propionic acid Formula: C29H37NO7 MolecularWeight: 511.60658

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H37NO7/c1-4-7-21-24(14-10-19-9-11-20(37-27(19)21)12-16-26(31)32)35-17-6-18-36-25-15-13-23(29(30)33)28(34-3)22(25)8-5-2/h5,10,13-15,20H,2,4,6-9,11-12,16-18H2,1,3H3,(H2,30,33)(H,31,32)