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

Systemtic Name: (phenylmethyl) 2-[[2-(2-methylpropyl)-4-oxidanylidene-3,1-benzoxazin-5-yl]methylcarbamoyl]pyrrolidine-1-carboxylate Openeye Name: benzyl 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 (phenylmethyl) ester IUPAC Name: benzyl 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 benzyl ester Formula: C26H29N3O5 MolecularWeight: 463.52556

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=NC2=CC=CC(=C2C(=O)O1)CNC(=O)C3CCCN3C(=O)OCC4=CC=CC=C4

Isomeric SMILES

CC(C)CC1=NC2=CC=CC(=C2C(=O)O1)CNC(=O)C3CCCN3C(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C26H29N3O5/c1-17(2)14-22-28-20-11-6-10-19(23(20)25(31)34-22)15-27-24(30)21-12-7-13-29(21)26(32)33-16-18-8-4-3-5-9-18/h3-6,8-11,17,21H,7,12-16H2,1-2H3,(H,27,30)