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

Systemtic Name: methyl 4-(1,3-benzodioxol-5-yl)-2,6,6-trimethyl-5-oxidanylidene-1,4,7,8-tetrahydroquinoline-3-carboxylate Openeye Name: methyl 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 methyl ester IUPAC Name: methyl 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 methyl ester Formula: C21H23NO5 MolecularWeight: 369.41102

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C2=C(N1)CCC(C2=O)(C)C)C3=CC4=C(C=C3)OCO4)C(=O)OC

Isomeric SMILES

CC1=C(C(C2=C(N1)CCC(C2=O)(C)C)C3=CC4=C(C=C3)OCO4)C(=O)OC

InChI

InChI=1S/C21H23NO5/c1-11-16(20(24)25-4)17(12-5-6-14-15(9-12)27-10-26-14)18-13(22-11)7-8-21(2,3)19(18)23/h5-6,9,17,22H,7-8,10H2,1-4H3