[(1S,3aR,5R,7S,7aS)-4-methylidene-1-[(1S)-1-oxidanylethyl]-2-oxidanylidene-7-propan-2-yl-3,3a,5,6,7,7a-hexahydro-1H-inden-5-yl] (E)-3-methylpent-2-enoate

Systemtic Name: [(1S,3aR,5R,7S,7aS)-4-methylidene-1-[(1S)-1-oxidanylethyl]-2-oxidanylidene-7-propan-2-yl-3,3a,5,6,7,7a-hexahydro-1H-inden-5-yl] (E)-3-methylpent-2-enoate Openeye Name: [(1S,3aR,5R,7S,7aS)-1-[(1S)-1-hydroxyethyl]-7-isopropyl-4-methylene-2-oxo-3,3a,5,6,7,7a-hexahydro-1H-inden-5-yl] (E)-3-methylpent-2-enoate CAS Name: (E)-3-methyl-2-pentenoic acid [(1S,3aR,5R,7S,7aS)-1-[(1S)-1-hydroxyethyl]-4-methylene-2-oxo-7-propan-2-yl-3,3a,5,6,7,7a-hexahydro-1H-inden-5-yl] ester IUPAC Name: [(1S,3aR,5R,7S,7aS)-1-[(1S)-1-hydroxyethyl]-4-methylidene-2-oxo-7-propan-2-yl-3,3a,5,6,7,7a-hexahydro-1H-inden-5-yl] (E)-3-methylpent-2-enoate Traditional Name: (E)-3-methylpent-2-enoic acid [(1S,3aR,5R,7S,7aS)-1-[(1S)-1-hydroxyethyl]-7-isopropyl-2-keto-4-methylene-3,3a,5,6,7,7a-hexahydro-1H-inden-5-yl] ester Formula: C21H32O4 MolecularWeight: 348.47638

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=CC(=O)OC1CC(C2C(C1=C)CC(=O)C2C(C)O)C(C)C)C

Isomeric SMILES

CC/C(=C/C(=O)O[C@@H]1C[C@H]([C@H]2[C@H](C1=C)CC(=O)[C@@H]2[C@H](C)O)C(C)C)/C

InChI

InChI=1S/C21H32O4/c1-7-12(4)8-19(24)25-18-10-15(11(2)3)21-16(13(18)5)9-17(23)20(21)14(6)22/h8,11,14-16,18,20-22H,5,7,9-10H2,1-4,6H3/b12-8+/t14-,15-,16-,18+,20-,21-/m0/s1