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

Systemtic Name: (9-methyl-4-oxidanylidene-pyrido[1,2-a]pyrimidin-2-yl)methyl 4-(1H-indol-3-yl)butanoate Openeye Name: (9-methyl-4-oxo-pyrido[1,2-a]pyrimidin-2-yl)methyl 4-(1H-indol-3-yl)butanoate CAS Name: 4-(1H-indol-3-yl)butanoic acid (9-methyl-4-oxo-2-pyrido[1,2-a]pyrimidinyl)methyl ester IUPAC Name: (9-methyl-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-keto-9-methyl-pyrido[1,2-a]pyrimidin-2-yl)methyl ester Formula: C22H21N3O3 MolecularWeight: 375.42044

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CN2C1=NC(=CC2=O)COC(=O)CCCC3=CNC4=CC=CC=C43

Isomeric SMILES

CC1=CC=CN2C1=NC(=CC2=O)COC(=O)CCCC3=CNC4=CC=CC=C43

InChI

InChI=1S/C22H21N3O3/c1-15-6-5-11-25-20(26)12-17(24-22(15)25)14-28-21(27)10-4-7-16-13-23-19-9-3-2-8-18(16)19/h2-3,5-6,8-9,11-13,23H,4,7,10,14H2,1H3