cyclopentyl (4R)-2,7,7-trimethyl-5-oxidanylidene-4-(4-oxidanylidenechromen-3-yl)-3,4,6,8-tetrahydroquinoline-3-carboxylate

Systemtic Name: cyclopentyl (4R)-2,7,7-trimethyl-5-oxidanylidene-4-(4-oxidanylidenechromen-3-yl)-3,4,6,8-tetrahydroquinoline-3-carboxylate Openeye Name: cyclopentyl (4R)-2,7,7-trimethyl-5-oxo-4-(4-oxochromen-3-yl)-3,4,6,8-tetrahydroquinoline-3-carboxylate CAS Name: (4R)-2,7,7-trimethyl-5-oxo-4-(4-oxo-1-benzopyran-3-yl)-3,4,6,8-tetrahydroquinoline-3-carboxylic acid cyclopentyl ester IUPAC Name: cyclopentyl (4R)-2,7,7-trimethyl-5-oxo-4-(4-oxochromen-3-yl)-3,4,6,8-tetrahydroquinoline-3-carboxylate Traditional Name: (4R)-5-keto-4-(4-ketochromen-3-yl)-2,7,7-trimethyl-3,4,6,8-tetrahydroquinoline-3-carboxylic acid cyclopentyl ester Formula: C27H29NO5 MolecularWeight: 447.52286

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C(C1C(=O)OC3CCCC3)C4=COC5=CC=CC=C5C4=O)C(=O)CC(C2)(C)C

Isomeric SMILES

CC1=NC2=C([C@@H](C1C(=O)OC3CCCC3)C4=COC5=CC=CC=C5C4=O)C(=O)CC(C2)(C)C

InChI

InChI=1S/C27H29NO5/c1-15-22(26(31)33-16-8-4-5-9-16)23(24-19(28-15)12-27(2,3)13-20(24)29)18-14-32-21-11-7-6-10-17(21)25(18)30/h6-7,10-11,14,16,22-23H,4-5,8-9,12-13H2,1-3H3/t22?,23-/m1/s1