[(3aR,4R,7aR)-5-[(2S)-5-acetyloxypentan-2-yl]-6-methyl-3-methylidene-2-oxidanylidene-3a,4,7,7a-tetrahydro-1-benzofuran-4-yl] (2E)-2-butoxyimino-3-phenyl-propanoate

Systemtic Name: [(3aR,4R,7aR)-5-[(2S)-5-acetyloxypentan-2-yl]-6-methyl-3-methylidene-2-oxidanylidene-3a,4,7,7a-tetrahydro-1-benzofuran-4-yl] (2E)-2-butoxyimino-3-phenyl-propanoate Openeye Name: [(3aR,4R,7aR)-5-[(1S)-4-acetoxy-1-methyl-butyl]-6-methyl-3-methylene-2-oxo-3a,4,7,7a-tetrahydrobenzofuran-4-yl] (2E)-2-butoxyimino-3-phenyl-propanoate CAS Name: (2E)-2-butoxyimino-3-phenylpropanoic acid [(3aR,4R,7aR)-5-[(2S)-5-acetyloxypentan-2-yl]-6-methyl-3-methylene-2-oxo-3a,4,7,7a-tetrahydrobenzofuran-4-yl] ester IUPAC Name: [(3aR,4R,7aR)-5-[(2S)-5-acetyloxypentan-2-yl]-6-methyl-3-methylidene-2-oxo-3a,4,7,7a-tetrahydro-1-benzofuran-4-yl] (2E)-2-butoxyimino-3-phenylpropanoate Traditional Name: (2E)-2-butyloximino-3-phenyl-propionic acid [(3aR,4R,7aR)-5-[(1S)-4-acetoxy-1-methyl-butyl]-2-keto-6-methyl-3-methylene-3a,4,7,7a-tetrahydrobenzofuran-4-yl] ester Formula: C30H39NO7 MolecularWeight: 525.63316

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Descriptors Computed from Structure

Canonical SMILES:

CCCCON=C(CC1=CC=CC=C1)C(=O)OC2C3C(CC(=C2C(C)CCCOC(=O)C)C)OC(=O)C3=C

Isomeric SMILES

CCCCO/N=C(\CC1=CC=CC=C1)/C(=O)O[C@@H]2[C@H]3[C@@H](CC(=C2[C@@H](C)CCCOC(=O)C)C)OC(=O)C3=C

InChI

InChI=1S/C30H39NO7/c1-6-7-16-36-31-24(18-23-13-9-8-10-14-23)30(34)38-28-26(19(2)12-11-15-35-22(5)32)20(3)17-25-27(28)21(4)29(33)37-25/h8-10,13-14,19,25,27-28H,4,6-7,11-12,15-18H2,1-3,5H3/b31-24+/t19-,25+,27+,28-/m0/s1