tert-butyl 3-[2-azanyl-2-oxidanylidene-1-[(phenylmethyl)amino]ethyl]pyrrolidine-1-carboxylate

Systemtic Name: tert-butyl 3-[2-azanyl-2-oxidanylidene-1-[(phenylmethyl)amino]ethyl]pyrrolidine-1-carboxylate Openeye Name: tert-butyl 3-[2-amino-1-(benzylamino)-2-oxo-ethyl]pyrrolidine-1-carboxylate CAS Name: 3-[2-amino-2-oxo-1-[(phenylmethyl)amino]ethyl]-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-[2-amino-1-(benzylamino)-2-oxoethyl]pyrrolidine-1-carboxylate Traditional Name: 3-[2-amino-1-(benzylamino)-2-keto-ethyl]pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C18H27N3O3 MolecularWeight: 333.42528

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(C1)C(C(=O)N)NCC2=CC=CC=C2

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(C1)C(C(=O)N)NCC2=CC=CC=C2

InChI

InChI=1S/C18H27N3O3/c1-18(2,3)24-17(23)21-10-9-14(12-21)15(16(19)22)20-11-13-7-5-4-6-8-13/h4-8,14-15,20H,9-12H2,1-3H3,(H2,19,22)