tert-butyl 3-[[5-(2-methylpropyl)-4,6-bis(oxidanyl)-3-oxidanylidene-pyrazin-2-yl]methyl]indole-1-carboxylate

Systemtic Name: tert-butyl 3-[[5-(2-methylpropyl)-4,6-bis(oxidanyl)-3-oxidanylidene-pyrazin-2-yl]methyl]indole-1-carboxylate Openeye Name: tert-butyl 3-[(4,6-dihydroxy-5-isobutyl-3-oxo-pyrazin-2-yl)methyl]indole-1-carboxylate CAS Name: 3-[[4,6-dihydroxy-5-(2-methylpropyl)-3-oxo-2-pyrazinyl]methyl]-1-indolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-[[4,6-dihydroxy-5-(2-methylpropyl)-3-oxopyrazin-2-yl]methyl]indole-1-carboxylate Traditional Name: 3-[(4,6-dihydroxy-5-isobutyl-3-keto-pyrazin-2-yl)methyl]indole-1-carboxylic acid tert-butyl ester Formula: C22H27N3O5 MolecularWeight: 413.46688

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=C(N=C(C(=O)N1O)CC2=CN(C3=CC=CC=C32)C(=O)OC(C)(C)C)O

Isomeric SMILES

CC(C)CC1=C(N=C(C(=O)N1O)CC2=CN(C3=CC=CC=C32)C(=O)OC(C)(C)C)O

InChI

InChI=1S/C22H27N3O5/c1-13(2)10-18-19(26)23-16(20(27)25(18)29)11-14-12-24(21(28)30-22(3,4)5)17-9-7-6-8-15(14)17/h6-9,12-13,26,29H,10-11H2,1-5H3