tert-butyl 2-[[6-azanyl-1-[(2-azanyl-2-oxidanylidene-ethyl)amino]-1-oxidanylidene-hexan-2-yl]carbamoyl]pyrrolidine-1-carboxylate

Systemtic Name: tert-butyl 2-[[6-azanyl-1-[(2-azanyl-2-oxidanylidene-ethyl)amino]-1-oxidanylidene-hexan-2-yl]carbamoyl]pyrrolidine-1-carboxylate Openeye Name: tert-butyl 2-[[5-amino-1-[(2-amino-2-oxo-ethyl)carbamoyl]pentyl]carbamoyl]pyrrolidine-1-carboxylate CAS Name: 2-[[[6-amino-1-[(2-amino-2-oxoethyl)amino]-1-oxohexan-2-yl]amino]-oxomethyl]-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2-[[6-amino-1-[(2-amino-2-oxoethyl)amino]-1-oxohexan-2-yl]carbamoyl]pyrrolidine-1-carboxylate Traditional Name: 2-[[5-amino-1-[(2-amino-2-keto-ethyl)carbamoyl]pentyl]carbamoyl]pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C18H33N5O5 MolecularWeight: 399.48512

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCCC1C(=O)NC(CCCCN)C(=O)NCC(=O)N

Isomeric SMILES

CC(C)(C)OC(=O)N1CCCC1C(=O)NC(CCCCN)C(=O)NCC(=O)N

InChI

InChI=1S/C18H33N5O5/c1-18(2,3)28-17(27)23-10-6-8-13(23)16(26)22-12(7-4-5-9-19)15(25)21-11-14(20)24/h12-13H,4-11,19H2,1-3H3,(H2,20,24)(H,21,25)(H,22,26)