oxolan-2-ylmethyl 2,7,7-trimethyl-5-oxidanylidene-4-(4-oxidanylidenechromen-3-yl)-1,4,4a,6-tetrahydroquinoline-3-carboxylate

Systemtic Name: oxolan-2-ylmethyl 2,7,7-trimethyl-5-oxidanylidene-4-(4-oxidanylidenechromen-3-yl)-1,4,4a,6-tetrahydroquinoline-3-carboxylate Openeye Name: tetrahydrofuran-2-ylmethyl 2,7,7-trimethyl-5-oxo-4-(4-oxochromen-3-yl)-1,4,4a,6-tetrahydroquinoline-3-carboxylate CAS Name: 2,7,7-trimethyl-5-oxo-4-(4-oxo-1-benzopyran-3-yl)-1,4,4a,6-tetrahydroquinoline-3-carboxylic acid 2-oxolanylmethyl ester IUPAC Name: oxolan-2-ylmethyl 2,7,7-trimethyl-5-oxo-4-(4-oxochromen-3-yl)-1,4,4a,6-tetrahydroquinoline-3-carboxylate Traditional Name: 5-keto-4-(4-ketochromen-3-yl)-2,7,7-trimethyl-1,4,4a,6-tetrahydroquinoline-3-carboxylic acid tetrahydrofurfuryl ester Formula: C27H29NO6 MolecularWeight: 463.52226

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C2C(=O)CC(C=C2N1)(C)C)C3=COC4=CC=CC=C4C3=O)C(=O)OCC5CCCO5

Isomeric SMILES

CC1=C(C(C2C(=O)CC(C=C2N1)(C)C)C3=COC4=CC=CC=C4C3=O)C(=O)OCC5CCCO5

InChI

InChI=1S/C27H29NO6/c1-15-22(26(31)34-13-16-7-6-10-32-16)23(24-19(28-15)11-27(2,3)12-20(24)29)18-14-33-21-9-5-4-8-17(21)25(18)30/h4-5,8-9,11,14,16,23-24,28H,6-7,10,12-13H2,1-3H3