tert-butyl 2-[[2-(2-methylpropyl)-4-oxidanylidene-3,1-benzoxazin-5-yl]methylcarbamoyl]pyrrolidine-1-carboxylate

Systemtic Name: tert-butyl 2-[[2-(2-methylpropyl)-4-oxidanylidene-3,1-benzoxazin-5-yl]methylcarbamoyl]pyrrolidine-1-carboxylate Openeye Name: tert-butyl 2-[(2-isobutyl-4-oxo-3,1-benzoxazin-5-yl)methylcarbamoyl]pyrrolidine-1-carboxylate CAS Name: 2-[[[2-(2-methylpropyl)-4-oxo-3,1-benzoxazin-5-yl]methylamino]-oxomethyl]-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2-[[2-(2-methylpropyl)-4-oxo-3,1-benzoxazin-5-yl]methylcarbamoyl]pyrrolidine-1-carboxylate Traditional Name: 2-[(2-isobutyl-4-keto-3,1-benzoxazin-5-yl)methylcarbamoyl]pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C23H31N3O5 MolecularWeight: 429.50934

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=NC2=CC=CC(=C2C(=O)O1)CNC(=O)C3CCCN3C(=O)OC(C)(C)C

Isomeric SMILES

CC(C)CC1=NC2=CC=CC(=C2C(=O)O1)CNC(=O)C3CCCN3C(=O)OC(C)(C)C

InChI

InChI=1S/C23H31N3O5/c1-14(2)12-18-25-16-9-6-8-15(19(16)21(28)30-18)13-24-20(27)17-10-7-11-26(17)22(29)31-23(3,4)5/h6,8-9,14,17H,7,10-13H2,1-5H3,(H,24,27)