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

Systemtic Name: methyl 2,7,7-trimethyl-5-oxidanylidene-4-(phenylmethoxymethyl)-1,4,6,8-tetrahydroquinoline-3-carboxylate Openeye Name: methyl 4-(benzyloxymethyl)-2,7,7-trimethyl-5-oxo-1,4,6,8-tetrahydroquinoline-3-carboxylate CAS Name: 2,7,7-trimethyl-5-oxo-4-(phenylmethoxymethyl)-1,4,6,8-tetrahydroquinoline-3-carboxylic acid methyl ester IUPAC Name: methyl 2,7,7-trimethyl-5-oxo-4-(phenylmethoxymethyl)-1,4,6,8-tetrahydroquinoline-3-carboxylate Traditional Name: 4-(benzoxymethyl)-5-keto-2,7,7-trimethyl-1,4,6,8-tetrahydroquinoline-3-carboxylic acid methyl ester Formula: C22H27NO4 MolecularWeight: 369.45408

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C2=C(N1)CC(CC2=O)(C)C)COCC3=CC=CC=C3)C(=O)OC

Isomeric SMILES

CC1=C(C(C2=C(N1)CC(CC2=O)(C)C)COCC3=CC=CC=C3)C(=O)OC

InChI

InChI=1S/C22H27NO4/c1-14-19(21(25)26-4)16(13-27-12-15-8-6-5-7-9-15)20-17(23-14)10-22(2,3)11-18(20)24/h5-9,16,23H,10-13H2,1-4H3