methyl (2S)-2-[2-[3-(2-oxidanylidene-1,3-benzoxazol-3-yl)propanoyloxy]ethanoylamino]-3-phenyl-propanoate

Systemtic Name: methyl (2S)-2-[2-[3-(2-oxidanylidene-1,3-benzoxazol-3-yl)propanoyloxy]ethanoylamino]-3-phenyl-propanoate Openeye Name: methyl (2S)-2-[[2-[3-(2-oxo-1,3-benzoxazol-3-yl)propanoyloxy]acetyl]amino]-3-phenyl-propanoate CAS Name: (2S)-2-[[1-oxo-2-[1-oxo-3-(2-oxo-1,3-benzoxazol-3-yl)propoxy]ethyl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl (2S)-2-[[2-[3-(2-oxo-1,3-benzoxazol-3-yl)propanoyloxy]acetyl]amino]-3-phenylpropanoate Traditional Name: (2S)-2-[[2-[3-(2-keto-1,3-benzoxazol-3-yl)propanoyloxy]acetyl]amino]-3-phenyl-propionic acid methyl ester Formula: C22H22N2O7 MolecularWeight: 426.41928

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CC=CC=C1)NC(=O)COC(=O)CCN2C3=CC=CC=C3OC2=O

Isomeric SMILES

COC(=O)[C@H](CC1=CC=CC=C1)NC(=O)COC(=O)CCN2C3=CC=CC=C3OC2=O

InChI

InChI=1S/C22H22N2O7/c1-29-21(27)16(13-15-7-3-2-4-8-15)23-19(25)14-30-20(26)11-12-24-17-9-5-6-10-18(17)31-22(24)28/h2-10,16H,11-14H2,1H3,(H,23,25)/t16-/m0/s1