methyl (3aS,8bS)-1-cyano-8b-(3-methylbut-2-enyl)-2-oxidanylidene-1,3a-dihydrofuro[2,3-b]indole-4-carboxylate

Systemtic Name: methyl (3aS,8bS)-1-cyano-8b-(3-methylbut-2-enyl)-2-oxidanylidene-1,3a-dihydrofuro[2,3-b]indole-4-carboxylate Openeye Name: methyl (3aS,8bS)-1-cyano-8b-(3-methylbut-2-enyl)-2-oxo-1,3a-dihydrofuro[2,3-b]indole-4-carboxylate CAS Name: (3aS,8bS)-1-cyano-8b-(3-methylbut-2-enyl)-2-oxo-1,3a-dihydrofuro[2,3-b]indole-4-carboxylic acid methyl ester IUPAC Name: methyl (3aS,8bS)-1-cyano-8b-(3-methylbut-2-enyl)-2-oxo-1,3a-dihydrofuro[2,3-b]indole-4-carboxylate Traditional Name: (3aS,8bS)-1-cyano-2-keto-8b-(3-methylbut-2-enyl)-1,3a-dihydrofur[2,3-b]indole-4-carboxylic acid methyl ester Formula: C18H18N2O4 MolecularWeight: 326.34652

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCC12C(C(=O)OC1N(C3=CC=CC=C23)C(=O)OC)C#N)C

Isomeric SMILES

CC(=CC[C@@]12[C@@H](N(C3=CC=CC=C31)C(=O)OC)OC(=O)C2C#N)C

InChI

InChI=1S/C18H18N2O4/c1-11(2)8-9-18-12-6-4-5-7-14(12)20(17(22)23-3)16(18)24-15(21)13(18)10-19/h4-8,13,16H,9H2,1-3H3/t13?,16-,18+/m0/s1