(3-methylquinoxalin-2-yl)methyl 1-[2-(tert-butylamino)-2-oxidanylidene-ethyl]cyclopentane-1-carboxylate

Systemtic Name: (3-methylquinoxalin-2-yl)methyl 1-[2-(tert-butylamino)-2-oxidanylidene-ethyl]cyclopentane-1-carboxylate Openeye Name: (3-methylquinoxalin-2-yl)methyl 1-[2-(tert-butylamino)-2-oxo-ethyl]cyclopentanecarboxylate CAS Name: 1-[2-(tert-butylamino)-2-oxoethyl]-1-cyclopentanecarboxylic acid (3-methyl-2-quinoxalinyl)methyl ester IUPAC Name: (3-methylquinoxalin-2-yl)methyl 1-[2-(tert-butylamino)-2-oxoethyl]cyclopentane-1-carboxylate Traditional Name: 1-[2-(tert-butylamino)-2-keto-ethyl]cyclopentanecarboxylic acid (3-methylquinoxalin-2-yl)methyl ester Formula: C22H29N3O3 MolecularWeight: 383.48396

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2N=C1COC(=O)C3(CCCC3)CC(=O)NC(C)(C)C

Isomeric SMILES

CC1=NC2=CC=CC=C2N=C1COC(=O)C3(CCCC3)CC(=O)NC(C)(C)C

InChI

InChI=1S/C22H29N3O3/c1-15-18(24-17-10-6-5-9-16(17)23-15)14-28-20(27)22(11-7-8-12-22)13-19(26)25-21(2,3)4/h5-6,9-10H,7-8,11-14H2,1-4H3,(H,25,26)