tert-butyl 2-[[(2-methylphenyl)carbonylamino]carbamoyl]pyrrolidine-1-carboxylate

Systemtic Name: tert-butyl 2-[[(2-methylphenyl)carbonylamino]carbamoyl]pyrrolidine-1-carboxylate Openeye Name: tert-butyl 2-[[(2-methylbenzoyl)amino]carbamoyl]pyrrolidine-1-carboxylate CAS Name: 2-[[[(2-methylphenyl)-oxomethyl]hydrazo]-oxomethyl]-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2-[[(2-methylbenzoyl)amino]carbamoyl]pyrrolidine-1-carboxylate Traditional Name: 2-[(o-toluoylamino)carbamoyl]pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C18H25N3O4 MolecularWeight: 347.4088

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)NNC(=O)C2CCCN2C(=O)OC(C)(C)C

Isomeric SMILES

CC1=CC=CC=C1C(=O)NNC(=O)C2CCCN2C(=O)OC(C)(C)C

InChI

InChI=1S/C18H25N3O4/c1-12-8-5-6-9-13(12)15(22)19-20-16(23)14-10-7-11-21(14)17(24)25-18(2,3)4/h5-6,8-9,14H,7,10-11H2,1-4H3,(H,19,22)(H,20,23)