(phenylmethyl) 4-(6-chloranyl-4-oxidanylidene-chromen-3-yl)-2-methyl-5-oxidanylidene-4,4a,6,7-tetrahydro-1H-quinoline-3-carboxylate

Systemtic Name: (phenylmethyl) 4-(6-chloranyl-4-oxidanylidene-chromen-3-yl)-2-methyl-5-oxidanylidene-4,4a,6,7-tetrahydro-1H-quinoline-3-carboxylate Openeye Name: benzyl 4-(6-chloro-4-oxo-chromen-3-yl)-2-methyl-5-oxo-4,4a,6,7-tetrahydro-1H-quinoline-3-carboxylate CAS Name: 4-(6-chloro-4-oxo-1-benzopyran-3-yl)-2-methyl-5-oxo-4,4a,6,7-tetrahydro-1H-quinoline-3-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 4-(6-chloro-4-oxochromen-3-yl)-2-methyl-5-oxo-4,4a,6,7-tetrahydro-1H-quinoline-3-carboxylate Traditional Name: 4-(6-chloro-4-keto-chromen-3-yl)-5-keto-2-methyl-4,4a,6,7-tetrahydro-1H-quinoline-3-carboxylic acid benzyl ester Formula: C27H22ClNO5 MolecularWeight: 475.92028

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C2C(=O)CCC=C2N1)C3=COC4=C(C3=O)C=C(C=C4)Cl)C(=O)OCC5=CC=CC=C5

Isomeric SMILES

CC1=C(C(C2C(=O)CCC=C2N1)C3=COC4=C(C3=O)C=C(C=C4)Cl)C(=O)OCC5=CC=CC=C5

InChI

InChI=1S/C27H22ClNO5/c1-15-23(27(32)34-13-16-6-3-2-4-7-16)24(25-20(29-15)8-5-9-21(25)30)19-14-33-22-11-10-17(28)12-18(22)26(19)31/h2-4,6-8,10-12,14,24-25,29H,5,9,13H2,1H3