2-(3-methyl-4-oxidanylidene-2-propyl-quinazolin-6-yl)oxyethyl pyridine-3-carboxylate

Systemtic Name: 2-(3-methyl-4-oxidanylidene-2-propyl-quinazolin-6-yl)oxyethyl pyridine-3-carboxylate Openeye Name: 2-(3-methyl-4-oxo-2-propyl-quinazolin-6-yl)oxyethyl pyridine-3-carboxylate CAS Name: 3-pyridinecarboxylic acid 2-[(3-methyl-4-oxo-2-propyl-6-quinazolinyl)oxy]ethyl ester IUPAC Name: 2-(3-methyl-4-oxo-2-propylquinazolin-6-yl)oxyethyl pyridine-3-carboxylate Traditional Name: nicotinic acid 2-(4-keto-3-methyl-2-propyl-quinazolin-6-yl)oxyethyl ester Formula: C20H21N3O4 MolecularWeight: 367.39844

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC2=C(C=C(C=C2)OCCOC(=O)C3=CN=CC=C3)C(=O)N1C

Isomeric SMILES

CCCC1=NC2=C(C=C(C=C2)OCCOC(=O)C3=CN=CC=C3)C(=O)N1C

InChI

InChI=1S/C20H21N3O4/c1-3-5-18-22-17-8-7-15(12-16(17)19(24)23(18)2)26-10-11-27-20(25)14-6-4-9-21-13-14/h4,6-9,12-13H,3,5,10-11H2,1-2H3