(4-oxidanylidenepyrido[1,2-a]pyrimidin-2-yl)methyl 4-(1H-indol-3-yl)butanoate

Systemtic Name: (4-oxidanylidenepyrido[1,2-a]pyrimidin-2-yl)methyl 4-(1H-indol-3-yl)butanoate Openeye Name: (4-oxopyrido[1,2-a]pyrimidin-2-yl)methyl 4-(1H-indol-3-yl)butanoate CAS Name: 4-(1H-indol-3-yl)butanoic acid (4-oxo-2-pyrido[1,2-a]pyrimidinyl)methyl ester IUPAC Name: (4-oxopyrido[1,2-a]pyrimidin-2-yl)methyl 4-(1H-indol-3-yl)butanoate Traditional Name: 4-(1H-indol-3-yl)butyric acid (4-ketopyrido[1,2-a]pyrimidin-2-yl)methyl ester Formula: C21H19N3O3 MolecularWeight: 361.39386

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2)CCCC(=O)OCC3=CC(=O)N4C=CC=CC4=N3

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2)CCCC(=O)OCC3=CC(=O)N4C=CC=CC4=N3

InChI

InChI=1S/C21H19N3O3/c25-20-12-16(23-19-9-3-4-11-24(19)20)14-27-21(26)10-5-6-15-13-22-18-8-2-1-7-17(15)18/h1-4,7-9,11-13,22H,5-6,10,14H2