phenylmethoxycarbonyl 1-azanyl-2-[2-[2,6-bis(azanyl)hexanoylamino]ethanoyl]cyclopentane-1-carboxylate

Systemtic Name: phenylmethoxycarbonyl 1-azanyl-2-[2-[2,6-bis(azanyl)hexanoylamino]ethanoyl]cyclopentane-1-carboxylate Openeye Name: benzyloxycarbonyl 1-amino-2-[2-(2,6-diaminohexanoylamino)acetyl]cyclopentanecarboxylate CAS Name: 1-amino-2-[2-[(2,6-diamino-1-oxohexyl)amino]-1-oxoethyl]-1-cyclopentanecarboxylic acid phenylmethoxycarbonyl ester IUPAC Name: phenylmethoxycarbonyl 1-amino-2-[2-(2,6-diaminohexanoylamino)acetyl]cyclopentane-1-carboxylate Traditional Name: 1-amino-2-[2-(2,6-diaminohexanoylamino)acetyl]cyclopentanecarboxylic acid carbobenzoxy ester Formula: C22H32N4O6 MolecularWeight: 448.51268

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C(C1)(C(=O)OC(=O)OCC2=CC=CC=C2)N)C(=O)CNC(=O)C(CCCCN)N

Isomeric SMILES

C1CC(C(C1)(C(=O)OC(=O)OCC2=CC=CC=C2)N)C(=O)CNC(=O)C(CCCCN)N

InChI

InChI=1S/C22H32N4O6/c23-12-5-4-10-17(24)19(28)26-13-18(27)16-9-6-11-22(16,25)20(29)32-21(30)31-14-15-7-2-1-3-8-15/h1-3,7-8,16-17H,4-6,9-14,23-25H2,(H,26,28)