O3-ethyl O5-prop-2-ynyl 2-azanyl-6-methyl-4-(9-oxidanylidenexanthen-4-yl)-1,4-dihydropyridine-3,5-dicarboxylate

Systemtic Name: O3-ethyl O5-prop-2-ynyl 2-azanyl-6-methyl-4-(9-oxidanylidenexanthen-4-yl)-1,4-dihydropyridine-3,5-dicarboxylate Openeye Name: O3-ethyl O5-prop-2-ynyl 2-amino-6-methyl-4-(9-oxoxanthen-4-yl)-1,4-dihydropyridine-3,5-dicarboxylate CAS Name: 2-amino-6-methyl-4-(9-oxo-4-xanthenyl)-1,4-dihydropyridine-3,5-dicarboxylic acid O3-ethyl ester O5-prop-2-ynyl ester IUPAC Name: 3-O-ethyl 5-O-prop-2-ynyl 2-amino-6-methyl-4-(9-oxoxanthen-4-yl)-1,4-dihydropyridine-3,5-dicarboxylate Traditional Name: 2-amino-4-(9-ketoxanthen-4-yl)-6-methyl-1,4-dihydropyridine-3,5-dicarboxylic acid O3-ethyl ester O5-propargyl ester Formula: C26H22N2O6 MolecularWeight: 458.46268

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C(C1C2=CC=CC3=C2OC4=CC=CC=C4C3=O)C(=O)OCC#C)C)N

Isomeric SMILES

CCOC(=O)C1=C(NC(=C(C1C2=CC=CC3=C2OC4=CC=CC=C4C3=O)C(=O)OCC#C)C)N

InChI

InChI=1S/C26H22N2O6/c1-4-13-33-25(30)19-14(3)28-24(27)21(26(31)32-5-2)20(19)16-10-8-11-17-22(29)15-9-6-7-12-18(15)34-23(16)17/h1,6-12,20,28H,5,13,27H2,2-3H3