ethyl 2-[furan-2-ylmethyl-[3-methyl-2-(phenylmethoxycarbonylamino)butanoyl]amino]ethanoate

Systemtic Name: ethyl 2-[furan-2-ylmethyl-[3-methyl-2-(phenylmethoxycarbonylamino)butanoyl]amino]ethanoate Openeye Name: ethyl 2-[[2-(benzyloxycarbonylamino)-3-methyl-butanoyl]-(2-furylmethyl)amino]acetate CAS Name: 2-[2-furanylmethyl-[3-methyl-1-oxo-2-(phenylmethoxycarbonylamino)butyl]amino]acetic acid ethyl ester IUPAC Name: ethyl 2-[furan-2-ylmethyl-[3-methyl-2-(phenylmethoxycarbonylamino)butanoyl]amino]acetate Traditional Name: 2-[[2-(benzyloxycarbonylamino)-3-methyl-butanoyl]-(2-furfuryl)amino]acetic acid ethyl ester Formula: C22H28N2O6 MolecularWeight: 416.46752

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN(CC1=CC=CO1)C(=O)C(C(C)C)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CCOC(=O)CN(CC1=CC=CO1)C(=O)C(C(C)C)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C22H28N2O6/c1-4-28-19(25)14-24(13-18-11-8-12-29-18)21(26)20(16(2)3)23-22(27)30-15-17-9-6-5-7-10-17/h5-12,16,20H,4,13-15H2,1-3H3,(H,23,27)