tert-butyl 2-[[5-[bis(azanyl)methylideneamino]-1-oxidanylidene-1-phenylmethoxy-pentan-2-yl]carbamoyl]pyrrolidine-1-carboxylate

Systemtic Name: tert-butyl 2-[[5-[bis(azanyl)methylideneamino]-1-oxidanylidene-1-phenylmethoxy-pentan-2-yl]carbamoyl]pyrrolidine-1-carboxylate Openeye Name: tert-butyl 2-[(1-benzyloxycarbonyl-4-guanidino-butyl)carbamoyl]pyrrolidine-1-carboxylate CAS Name: 2-[[[5-(diaminomethylideneamino)-1-oxo-1-phenylmethoxypentan-2-yl]amino]-oxomethyl]-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2-[[5-(diaminomethylideneamino)-1-oxo-1-phenylmethoxypentan-2-yl]carbamoyl]pyrrolidine-1-carboxylate Traditional Name: 2-[(1-carbobenzoxy-4-guanidino-butyl)carbamoyl]pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C23H35N5O5 MolecularWeight: 461.5545

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCCC1C(=O)NC(CCCN=C(N)N)C(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC(C)(C)OC(=O)N1CCCC1C(=O)NC(CCCN=C(N)N)C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C23H35N5O5/c1-23(2,3)33-22(31)28-14-8-12-18(28)19(29)27-17(11-7-13-26-21(24)25)20(30)32-15-16-9-5-4-6-10-16/h4-6,9-10,17-18H,7-8,11-15H2,1-3H3,(H,27,29)(H4,24,25,26)