(3,3-dimethyl-2-oxidanylidene-butyl) (6S)-6-methyl-6,7,8,9-tetrahydro-5H-carbazole-3-carboxylate

Systemtic Name: (3,3-dimethyl-2-oxidanylidene-butyl) (6S)-6-methyl-6,7,8,9-tetrahydro-5H-carbazole-3-carboxylate Openeye Name: (3,3-dimethyl-2-oxo-butyl) (6S)-6-methyl-6,7,8,9-tetrahydro-5H-carbazole-3-carboxylate CAS Name: (6S)-6-methyl-6,7,8,9-tetrahydro-5H-carbazole-3-carboxylic acid (3,3-dimethyl-2-oxobutyl) ester IUPAC Name: (3,3-dimethyl-2-oxobutyl) (6S)-6-methyl-6,7,8,9-tetrahydro-5H-carbazole-3-carboxylate Traditional Name: (6S)-6-methyl-6,7,8,9-tetrahydro-5H-carbazole-3-carboxylic acid (2-keto-3,3-dimethyl-butyl) ester Formula: C20H25NO3 MolecularWeight: 327.4174

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)C3=C(N2)C=CC(=C3)C(=O)OCC(=O)C(C)(C)C

Isomeric SMILES

C[C@H]1CCC2=C(C1)C3=C(N2)C=CC(=C3)C(=O)OCC(=O)C(C)(C)C

InChI

InChI=1S/C20H25NO3/c1-12-5-7-16-14(9-12)15-10-13(6-8-17(15)21-16)19(23)24-11-18(22)20(2,3)4/h6,8,10,12,21H,5,7,9,11H2,1-4H3/t12-/m0/s1