ethyl (3aS,7R,7aR)-2-methyl-7-pentan-3-yloxy-3-prop-2-enyl-3a,4,7,7a-tetrahydrobenzimidazole-5-carboxylate

Systemtic Name: ethyl (3aS,7R,7aR)-2-methyl-7-pentan-3-yloxy-3-prop-2-enyl-3a,4,7,7a-tetrahydrobenzimidazole-5-carboxylate Openeye Name: ethyl (3aS,7R,7aR)-3-allyl-7-(1-ethylpropoxy)-2-methyl-3a,4,7,7a-tetrahydrobenzimidazole-5-carboxylate CAS Name: (3aS,7R,7aR)-2-methyl-7-pentan-3-yloxy-3-prop-2-enyl-3a,4,7,7a-tetrahydrobenzimidazole-5-carboxylic acid ethyl ester IUPAC Name: ethyl (3aS,7R,7aR)-2-methyl-7-pentan-3-yloxy-3-prop-2-enyl-3a,4,7,7a-tetrahydrobenzimidazole-5-carboxylate Traditional Name: (3aS,7R,7aR)-3-allyl-7-(1-ethylpropoxy)-2-methyl-3a,4,7,7a-tetrahydrobenzimidazole-5-carboxylic acid ethyl ester Formula: C19H30N2O3 MolecularWeight: 334.4531

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)OC1C=C(CC2C1N=C(N2CC=C)C)C(=O)OCC

Isomeric SMILES

CCC(CC)O[C@@H]1C=C(C[C@H]2[C@H]1N=C(N2CC=C)C)C(=O)OCC

InChI

InChI=1S/C19H30N2O3/c1-6-10-21-13(5)20-18-16(21)11-14(19(22)23-9-4)12-17(18)24-15(7-2)8-3/h6,12,15-18H,1,7-11H2,2-5H3/t16-,17+,18+/m0/s1