(phenylmethyl) 2-[2,3-bis(azanyl)-4-methyl-3-propan-2-yl-pentanoyl]pyrrolidine-1-carboxylate

Systemtic Name: (phenylmethyl) 2-[2,3-bis(azanyl)-4-methyl-3-propan-2-yl-pentanoyl]pyrrolidine-1-carboxylate Openeye Name: benzyl 2-(2,3-diamino-3-isopropyl-4-methyl-pentanoyl)pyrrolidine-1-carboxylate CAS Name: 2-(2,3-diamino-4-methyl-1-oxo-3-propan-2-ylpentyl)-1-pyrrolidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 2-(2,3-diamino-4-methyl-3-propan-2-ylpentanoyl)pyrrolidine-1-carboxylate Traditional Name: 2-(2,3-diamino-3-isopropyl-4-methyl-pentanoyl)pyrrolidine-1-carboxylic acid benzyl ester Formula: C21H33N3O3 MolecularWeight: 375.50502

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(C)C)(C(C(=O)C1CCCN1C(=O)OCC2=CC=CC=C2)N)N

Isomeric SMILES

CC(C)C(C(C)C)(C(C(=O)C1CCCN1C(=O)OCC2=CC=CC=C2)N)N

InChI

InChI=1S/C21H33N3O3/c1-14(2)21(23,15(3)4)19(22)18(25)17-11-8-12-24(17)20(26)27-13-16-9-6-5-7-10-16/h5-7,9-10,14-15,17,19H,8,11-13,22-23H2,1-4H3