methyl 2,4-dimethyl-7-oxidanylidene-4-phenyl-3,5,6,7a-tetrahydro-1H-isoindole-3a-carboxylate

Systemtic Name: methyl 2,4-dimethyl-7-oxidanylidene-4-phenyl-3,5,6,7a-tetrahydro-1H-isoindole-3a-carboxylate Openeye Name: methyl 2,4-dimethyl-7-oxo-4-phenyl-3,5,6,7a-tetrahydro-1H-isoindole-3a-carboxylate CAS Name: 2,4-dimethyl-7-oxo-4-phenyl-3,5,6,7a-tetrahydro-1H-isoindole-3a-carboxylic acid methyl ester IUPAC Name: methyl 2,4-dimethyl-7-oxo-4-phenyl-3,5,6,7a-tetrahydro-1H-isoindole-3a-carboxylate Traditional Name: 7-keto-2,4-dimethyl-4-phenyl-3,5,6,7a-tetrahydro-1H-isoindole-3a-carboxylic acid methyl ester Formula: C18H23NO3 MolecularWeight: 301.38012

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCC(=O)C2C1(CN(C2)C)C(=O)OC)C3=CC=CC=C3

Isomeric SMILES

CC1(CCC(=O)C2C1(CN(C2)C)C(=O)OC)C3=CC=CC=C3

InChI

InChI=1S/C18H23NO3/c1-17(13-7-5-4-6-8-13)10-9-15(20)14-11-19(2)12-18(14,17)16(21)22-3/h4-8,14H,9-12H2,1-3H3