tert-butyl 3-(3-azabicyclo[3.1.0]hexan-6-ylcarbamoyl)-3,4-dihydro-1H-isoquinoline-2-carboxylate

Systemtic Name: tert-butyl 3-(3-azabicyclo[3.1.0]hexan-6-ylcarbamoyl)-3,4-dihydro-1H-isoquinoline-2-carboxylate Openeye Name: tert-butyl 3-(3-azabicyclo[3.1.0]hexan-6-ylcarbamoyl)-3,4-dihydro-1H-isoquinoline-2-carboxylate CAS Name: 3-[(3-azabicyclo[3.1.0]hexan-6-ylamino)-oxomethyl]-3,4-dihydro-1H-isoquinoline-2-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-(3-azabicyclo[3.1.0]hexan-6-ylcarbamoyl)-3,4-dihydro-1H-isoquinoline-2-carboxylate Traditional Name: 3-(3-azabicyclo[3.1.0]hexan-6-ylcarbamoyl)-3,4-dihydro-1H-isoquinoline-2-carboxylic acid tert-butyl ester Formula: C20H27N3O3 MolecularWeight: 357.44668

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CC2=CC=CC=C2CC1C(=O)NC3C4C3CNC4

Isomeric SMILES

CC(C)(C)OC(=O)N1CC2=CC=CC=C2CC1C(=O)NC3C4C3CNC4

InChI

InChI=1S/C20H27N3O3/c1-20(2,3)26-19(25)23-11-13-7-5-4-6-12(13)8-16(23)18(24)22-17-14-9-21-10-15(14)17/h4-7,14-17,21H,8-11H2,1-3H3,(H,22,24)