ethyl 4-(1,3-benzodioxol-5-yl)-2,6,6-trimethyl-5-oxidanylidene-1,4,7,8-tetrahydroquinoline-3-carboxylate

Systemtic Name: ethyl 4-(1,3-benzodioxol-5-yl)-2,6,6-trimethyl-5-oxidanylidene-1,4,7,8-tetrahydroquinoline-3-carboxylate Openeye Name: ethyl 4-(1,3-benzodioxol-5-yl)-2,6,6-trimethyl-5-oxo-1,4,7,8-tetrahydroquinoline-3-carboxylate CAS Name: 4-(1,3-benzodioxol-5-yl)-2,6,6-trimethyl-5-oxo-1,4,7,8-tetrahydroquinoline-3-carboxylic acid ethyl ester IUPAC Name: ethyl 4-(1,3-benzodioxol-5-yl)-2,6,6-trimethyl-5-oxo-1,4,7,8-tetrahydroquinoline-3-carboxylate Traditional Name: 4-(1,3-benzodioxol-5-yl)-5-keto-2,6,6-trimethyl-1,4,7,8-tetrahydroquinoline-3-carboxylic acid ethyl ester Formula: C22H25NO5 MolecularWeight: 383.4376

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC2=C(C1C3=CC4=C(C=C3)OCO4)C(=O)C(CC2)(C)C)C

Isomeric SMILES

CCOC(=O)C1=C(NC2=C(C1C3=CC4=C(C=C3)OCO4)C(=O)C(CC2)(C)C)C

InChI

InChI=1S/C22H25NO5/c1-5-26-21(25)17-12(2)23-14-8-9-22(3,4)20(24)19(14)18(17)13-6-7-15-16(10-13)28-11-27-15/h6-7,10,18,23H,5,8-9,11H2,1-4H3