2-piperidin-1-ylethyl (Z)-6-[4-(2,2-dimethylpropanoyloxy)-6-methoxy-7-methyl-3-oxidanylidene-1H-2-benzofuran-5-yl]-4-methyl-hex-4-enoate

Systemtic Name: 2-piperidin-1-ylethyl (Z)-6-[4-(2,2-dimethylpropanoyloxy)-6-methoxy-7-methyl-3-oxidanylidene-1H-2-benzofuran-5-yl]-4-methyl-hex-4-enoate Openeye Name: 2-(1-piperidyl)ethyl (Z)-6-[4-(2,2-dimethylpropanoyloxy)-6-methoxy-7-methyl-3-oxo-1H-isobenzofuran-5-yl]-4-methyl-hex-4-enoate CAS Name: (Z)-6-[4-(2,2-dimethyl-1-oxopropoxy)-6-methoxy-7-methyl-3-oxo-1H-isobenzofuran-5-yl]-4-methyl-4-hexenoic acid 2-(1-piperidinyl)ethyl ester IUPAC Name: 2-piperidin-1-ylethyl (Z)-6-[4-(2,2-dimethylpropanoyloxy)-6-methoxy-7-methyl-3-oxo-1H-2-benzofuran-5-yl]-4-methylhex-4-enoate Traditional Name: (Z)-6-(3-keto-6-methoxy-7-methyl-4-pivaloyloxy-phthalan-5-yl)-4-methyl-hex-4-enoic acid 2-piperidinoethyl ester Formula: C29H41NO7 MolecularWeight: 515.63834

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C2=C1COC2=O)OC(=O)C(C)(C)C)CC=C(C)CCC(=O)OCCN3CCCCC3)OC

Isomeric SMILES

CC1=C(C(=C(C2=C1COC2=O)OC(=O)C(C)(C)C)C/C=C(/C)\CCC(=O)OCCN3CCCCC3)OC

InChI

InChI=1S/C29H41NO7/c1-19(11-13-23(31)35-17-16-30-14-8-7-9-15-30)10-12-21-25(34-6)20(2)22-18-36-27(32)24(22)26(21)37-28(33)29(3,4)5/h10H,7-9,11-18H2,1-6H3/b19-10-