2-azanylethanoyl 1-azanyl-2-ethyl-2-[2-(phenylmethoxycarbonylamino)propanoyl]cyclopentane-1-carboxylate

Systemtic Name: 2-azanylethanoyl 1-azanyl-2-ethyl-2-[2-(phenylmethoxycarbonylamino)propanoyl]cyclopentane-1-carboxylate Openeye Name: (2-aminoacetyl) 1-amino-2-[2-(benzyloxycarbonylamino)propanoyl]-2-ethyl-cyclopentanecarboxylate CAS Name: 1-amino-2-ethyl-2-[1-oxo-2-(phenylmethoxycarbonylamino)propyl]-1-cyclopentanecarboxylic acid (2-amino-1-oxoethyl) ester IUPAC Name: (2-aminoacetyl) 1-amino-2-ethyl-2-[2-(phenylmethoxycarbonylamino)propanoyl]cyclopentane-1-carboxylate Traditional Name: 1-amino-2-[2-(benzyloxycarbonylamino)propanoyl]-2-ethyl-cyclopentanecarboxylic acid glycyl ester Formula: C21H29N3O6 MolecularWeight: 419.47146

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(CCCC1(C(=O)OC(=O)CN)N)C(=O)C(C)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CCC1(CCCC1(C(=O)OC(=O)CN)N)C(=O)C(C)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C21H29N3O6/c1-3-20(10-7-11-21(20,23)18(27)30-16(25)12-22)17(26)14(2)24-19(28)29-13-15-8-5-4-6-9-15/h4-6,8-9,14H,3,7,10-13,22-23H2,1-2H3,(H,24,28)