O3-methyl O5-prop-2-ynyl 4-(2-chloranyl-9-oxidanylidene-xanthen-4-yl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate

Systemtic Name: O3-methyl O5-prop-2-ynyl 4-(2-chloranyl-9-oxidanylidene-xanthen-4-yl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate Openeye Name: O3-methyl O5-prop-2-ynyl 4-(2-chloro-9-oxo-xanthen-4-yl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate CAS Name: 4-(2-chloro-9-oxo-4-xanthenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid O3-methyl ester O5-prop-2-ynyl ester IUPAC Name: 3-O-methyl 5-O-prop-2-ynyl 4-(2-chloro-9-oxoxanthen-4-yl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate Traditional Name: 4-(2-chloro-9-keto-xanthen-4-yl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid O3-methyl ester O5-propargyl ester Formula: C26H20ClNO6 MolecularWeight: 477.8931

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)C)C(=O)OCC#C)C2=C3C(=CC(=C2)Cl)C(=O)C4=CC=CC=C4O3)C(=O)OC

Isomeric SMILES

CC1=C(C(C(=C(N1)C)C(=O)OCC#C)C2=C3C(=CC(=C2)Cl)C(=O)C4=CC=CC=C4O3)C(=O)OC

InChI

InChI=1S/C26H20ClNO6/c1-5-10-33-26(31)21-14(3)28-13(2)20(25(30)32-4)22(21)17-11-15(27)12-18-23(29)16-8-6-7-9-19(16)34-24(17)18/h1,6-9,11-12,22,28H,10H2,2-4H3