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

Systemtic Name: methyl 2-[[(2S)-2-azanyl-3-(3,4-diacetyloxyphenyl)propanoyl]amino]ethanoate Openeye Name: methyl 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 methyl ester IUPAC Name: methyl 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 methyl ester Formula: C16H20N2O7 MolecularWeight: 352.3392

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H20N2O7/c1-9(19)24-13-5-4-11(7-14(13)25-10(2)20)6-12(17)16(22)18-8-15(21)23-3/h4-5,7,12H,6,8,17H2,1-3H3,(H,18,22)/t12-/m0/s1