(phenylmethyl) 2-[[(2S)-2-azanyl-3-(3,4-diacetyloxyphenyl)propanoyl]amino]ethanoate

Systemtic Name: (phenylmethyl) 2-[[(2S)-2-azanyl-3-(3,4-diacetyloxyphenyl)propanoyl]amino]ethanoate Openeye Name: benzyl 2-[[(2S)-2-amino-3-(3,4-diacetoxyphenyl)propanoyl]amino]acetate CAS Name: 2-[[(2S)-2-amino-3-(3,4-diacetyloxyphenyl)-1-oxopropyl]amino]acetic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[[(2S)-2-amino-3-(3,4-diacetyloxyphenyl)propanoyl]amino]acetate Traditional Name: 2-[[(2S)-2-amino-3-(3,4-diacetoxyphenyl)propanoyl]amino]acetic acid benzyl ester Formula: C22H24N2O7 MolecularWeight: 428.43516

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=C(C=C(C=C1)CC(C(=O)NCC(=O)OCC2=CC=CC=C2)N)OC(=O)C

Isomeric SMILES

CC(=O)OC1=C(C=C(C=C1)C[C@@H](C(=O)NCC(=O)OCC2=CC=CC=C2)N)OC(=O)C

InChI

InChI=1S/C22H24N2O7/c1-14(25)30-19-9-8-17(11-20(19)31-15(2)26)10-18(23)22(28)24-12-21(27)29-13-16-6-4-3-5-7-16/h3-9,11,18H,10,12-13,23H2,1-2H3,(H,24,28)/t18-/m0/s1