(3-methylquinoxalin-2-yl)methyl 4-(2-oxidanylidenepiperidin-1-yl)benzoate

Systemtic Name: (3-methylquinoxalin-2-yl)methyl 4-(2-oxidanylidenepiperidin-1-yl)benzoate Openeye Name: (3-methylquinoxalin-2-yl)methyl 4-(2-oxo-1-piperidyl)benzoate CAS Name: 4-(2-oxo-1-piperidinyl)benzoic acid (3-methyl-2-quinoxalinyl)methyl ester IUPAC Name: (3-methylquinoxalin-2-yl)methyl 4-(2-oxopiperidin-1-yl)benzoate Traditional Name: 4-(2-ketopiperidino)benzoic acid (3-methylquinoxalin-2-yl)methyl ester Formula: C22H21N3O3 MolecularWeight: 375.42044

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2N=C1COC(=O)C3=CC=C(C=C3)N4CCCCC4=O

Isomeric SMILES

CC1=NC2=CC=CC=C2N=C1COC(=O)C3=CC=C(C=C3)N4CCCCC4=O

InChI

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