tert-butyl 2-(3,4-dihydro-2H-chromen-3-ylmethylcarbamoyl)pyrrolidine-1-carboxylate

Systemtic Name: tert-butyl 2-(3,4-dihydro-2H-chromen-3-ylmethylcarbamoyl)pyrrolidine-1-carboxylate Openeye Name: tert-butyl 2-(chroman-3-ylmethylcarbamoyl)pyrrolidine-1-carboxylate CAS Name: 2-[(3,4-dihydro-2H-1-benzopyran-3-ylmethylamino)-oxomethyl]-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2-(3,4-dihydro-2H-chromen-3-ylmethylcarbamoyl)pyrrolidine-1-carboxylate Traditional Name: 2-(chroman-3-ylmethylcarbamoyl)pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C20H28N2O4 MolecularWeight: 360.44732

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCCC1C(=O)NCC2CC3=CC=CC=C3OC2

Isomeric SMILES

CC(C)(C)OC(=O)N1CCCC1C(=O)NCC2CC3=CC=CC=C3OC2

InChI

InChI=1S/C20H28N2O4/c1-20(2,3)26-19(24)22-10-6-8-16(22)18(23)21-12-14-11-15-7-4-5-9-17(15)25-13-14/h4-5,7,9,14,16H,6,8,10-13H2,1-3H3,(H,21,23)