4-pyrazolidin-1-ylbutyl (Z)-6-(6-methoxy-7-methyl-4-oxidanyl-3-oxidanylidene-1H-2-benzofuran-5-yl)-4-methyl-hex-4-enoate

Systemtic Name: 4-pyrazolidin-1-ylbutyl (Z)-6-(6-methoxy-7-methyl-4-oxidanyl-3-oxidanylidene-1H-2-benzofuran-5-yl)-4-methyl-hex-4-enoate Openeye Name: 4-pyrazolidin-1-ylbutyl (Z)-6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1H-isobenzofuran-5-yl)-4-methyl-hex-4-enoate CAS Name: (Z)-6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1H-isobenzofuran-5-yl)-4-methyl-4-hexenoic acid 4-(1-pyrazolidinyl)butyl ester IUPAC Name: 4-pyrazolidin-1-ylbutyl (Z)-6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1H-2-benzofuran-5-yl)-4-methylhex-4-enoate Traditional Name: (Z)-6-(4-hydroxy-3-keto-6-methoxy-7-methyl-phthalan-5-yl)-4-methyl-hex-4-enoic acid 4-pyrazolidin-1-ylbutyl ester Formula: C24H34N2O6 MolecularWeight: 446.53656

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C2=C1COC2=O)O)CC=C(C)CCC(=O)OCCCCN3CCCN3)OC

Isomeric SMILES

CC1=C(C(=C(C2=C1COC2=O)O)C/C=C(/C)\CCC(=O)OCCCCN3CCCN3)OC

InChI

InChI=1S/C24H34N2O6/c1-16(8-10-20(27)31-14-5-4-12-26-13-6-11-25-26)7-9-18-22(28)21-19(15-32-24(21)29)17(2)23(18)30-3/h7,25,28H,4-6,8-15H2,1-3H3/b16-7-