4-pyridin-3-ylbutyl 11-oxidanylidene-2-propan-2-yl-pyrido[2,1-b]quinazoline-8-carboxylate

Systemtic Name: 4-pyridin-3-ylbutyl 11-oxidanylidene-2-propan-2-yl-pyrido[2,1-b]quinazoline-8-carboxylate Openeye Name: 4-(3-pyridyl)butyl 2-isopropyl-11-oxo-pyrido[2,1-b]quinazoline-8-carboxylate CAS Name: 11-oxo-2-propan-2-yl-8-pyrido[2,1-b]quinazolinecarboxylic acid 4-(3-pyridinyl)butyl ester IUPAC Name: 4-pyridin-3-ylbutyl 11-oxo-2-propan-2-ylpyrido[2,1-b]quinazoline-8-carboxylate Traditional Name: 2-isopropyl-11-keto-pyrido[2,1-b]quinazoline-8-carboxylic acid 4-(3-pyridyl)butyl ester Formula: C25H25N3O3 MolecularWeight: 415.4843

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC2=C(C=C1)N=C3C=CC(=CN3C2=O)C(=O)OCCCCC4=CN=CC=C4

Isomeric SMILES

CC(C)C1=CC2=C(C=C1)N=C3C=CC(=CN3C2=O)C(=O)OCCCCC4=CN=CC=C4

InChI

InChI=1S/C25H25N3O3/c1-17(2)19-8-10-22-21(14-19)24(29)28-16-20(9-11-23(28)27-22)25(30)31-13-4-3-6-18-7-5-12-26-15-18/h5,7-12,14-17H,3-4,6,13H2,1-2H3