(Z)-6-[4-(dimethylcarbamoylamino)-7-methyl-3-oxidanylidene-6-pent-2-ynyl-1H-2-benzofuran-5-yl]-4-methyl-hex-4-enoic acid

Systemtic Name: (Z)-6-[4-(dimethylcarbamoylamino)-7-methyl-3-oxidanylidene-6-pent-2-ynyl-1H-2-benzofuran-5-yl]-4-methyl-hex-4-enoic acid Openeye Name: (Z)-6-[4-(dimethylcarbamoylamino)-7-methyl-3-oxo-6-pent-2-ynyl-1H-isobenzofuran-5-yl]-4-methyl-hex-4-enoic acid CAS Name: (Z)-6-[4-[[dimethylamino(oxo)methyl]amino]-7-methyl-3-oxo-6-pent-2-ynyl-1H-isobenzofuran-5-yl]-4-methyl-4-hexenoic acid IUPAC Name: (Z)-6-[4-(dimethylcarbamoylamino)-7-methyl-3-oxo-6-pent-2-ynyl-1H-2-benzofuran-5-yl]-4-methylhex-4-enoic acid Traditional Name: (Z)-6-[4-(dimethylcarbamoylamino)-3-keto-7-methyl-6-pent-2-ynyl-phthalan-5-yl]-4-methyl-hex-4-enoic acid Formula: C24H30N2O5 MolecularWeight: 426.5054

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC#CCC1=C(C2=C(C(=C1CC=C(C)CCC(=O)O)NC(=O)N(C)C)C(=O)OC2)C

Isomeric SMILES

CCC#CCC1=C(C2=C(C(=C1C/C=C(/C)\CCC(=O)O)NC(=O)N(C)C)C(=O)OC2)C

InChI

InChI=1S/C24H30N2O5/c1-6-7-8-9-17-16(3)19-14-31-23(29)21(19)22(25-24(30)26(4)5)18(17)12-10-15(2)11-13-20(27)28/h10H,6,9,11-14H2,1-5H3,(H,25,30)(H,27,28)/b15-10-