tert-butyl 1-azabicyclo[2.2.0]hexane-3-carboxylate; 3-(1H-indol-3-yl)-4-phenylazanyl-1-propyl-pyrrole-2,5-dione

Systemtic Name: tert-butyl 1-azabicyclo[2.2.0]hexane-3-carboxylate; 3-(1H-indol-3-yl)-4-phenylazanyl-1-propyl-pyrrole-2,5-dione Openeye Name: 3-anilino-4-(1H-indol-3-yl)-1-propyl-pyrrole-2,5-dione; tert-butyl 1-azabicyclo[2.2.0]hexane-3-carboxylate CAS Name: 3-anilino-4-(1H-indol-3-yl)-1-propylpyrrole-2,5-dione; 1-azabicyclo[2.2.0]hexane-3-carboxylic acid tert-butyl ester IUPAC Name: 3-anilino-4-(1H-indol-3-yl)-1-propylpyrrole-2,5-dione; tert-butyl 1-azabicyclo[2.2.0]hexane-3-carboxylate Traditional Name: 3-anilino-4-(1H-indol-3-yl)-1-propyl-3-pyrroline-2,5-quinone; 1-azabicyclo[2.2.0]hexane-3-carboxylic acid tert-butyl ester Formula: C31H36N4O4 MolecularWeight: 528.64194

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C(=C(C1=O)NC2=CC=CC=C2)C3=CNC4=CC=CC=C43.CC(C)(C)OC(=O)C1CN2C1CC2

Isomeric SMILES

CCCN1C(=O)C(=C(C1=O)NC2=CC=CC=C2)C3=CNC4=CC=CC=C43.CC(C)(C)OC(=O)C1CN2C1CC2

InChI

InChI=1S/C21H19N3O2.C10H17NO2/c1-2-12-24-20(25)18(16-13-22-17-11-7-6-10-15(16)17)19(21(24)26)23-14-8-4-3-5-9-14;1-10(2,3)13-9(12)7-6-11-5-4-8(7)11/h3-11,13,22-23H,2,12H2,1H3;7-8H,4-6H2,1-3H3