tert-butyl 6-azanyl-2-[4-(1H-indol-3-ylmethyl)-2,5-bis(oxidanylidene)imidazolidin-1-yl]hexanoate

Systemtic Name: tert-butyl 6-azanyl-2-[4-(1H-indol-3-ylmethyl)-2,5-bis(oxidanylidene)imidazolidin-1-yl]hexanoate Openeye Name: tert-butyl 6-amino-2-[4-(1H-indol-3-ylmethyl)-2,5-dioxo-imidazolidin-1-yl]hexanoate CAS Name: 6-amino-2-[4-(1H-indol-3-ylmethyl)-2,5-dioxo-1-imidazolidinyl]hexanoic acid tert-butyl ester IUPAC Name: tert-butyl 6-amino-2-[4-(1H-indol-3-ylmethyl)-2,5-dioxoimidazolidin-1-yl]hexanoate Traditional Name: 6-amino-2-[4-(1H-indol-3-ylmethyl)-2,5-diketo-imidazolidin-1-yl]hexanoic acid tert-butyl ester Formula: C22H30N4O4 MolecularWeight: 414.498

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C(CCCCN)N1C(=O)C(NC1=O)CC2=CNC3=CC=CC=C32

Isomeric SMILES

CC(C)(C)OC(=O)C(CCCCN)N1C(=O)C(NC1=O)CC2=CNC3=CC=CC=C32

InChI

InChI=1S/C22H30N4O4/c1-22(2,3)30-20(28)18(10-6-7-11-23)26-19(27)17(25-21(26)29)12-14-13-24-16-9-5-4-8-15(14)16/h4-5,8-9,13,17-18,24H,6-7,10-12,23H2,1-3H3,(H,25,29)