methyl 2-[2-[3-(6-chloranyl-2-oxidanylidene-1,3-benzoxazol-3-yl)propanoyloxy]ethanoylamino]-3-phenyl-propanoate

Systemtic Name: methyl 2-[2-[3-(6-chloranyl-2-oxidanylidene-1,3-benzoxazol-3-yl)propanoyloxy]ethanoylamino]-3-phenyl-propanoate Openeye Name: methyl 2-[[2-[3-(6-chloro-2-oxo-1,3-benzoxazol-3-yl)propanoyloxy]acetyl]amino]-3-phenyl-propanoate CAS Name: 2-[[2-[3-(6-chloro-2-oxo-1,3-benzoxazol-3-yl)-1-oxopropoxy]-1-oxoethyl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl 2-[[2-[3-(6-chloro-2-oxo-1,3-benzoxazol-3-yl)propanoyloxy]acetyl]amino]-3-phenylpropanoate Traditional Name: 2-[[2-[3-(6-chloro-2-keto-1,3-benzoxazol-3-yl)propanoyloxy]acetyl]amino]-3-phenyl-propionic acid methyl ester Formula: C22H21ClN2O7 MolecularWeight: 460.86434

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CC=CC=C1)NC(=O)COC(=O)CCN2C3=C(C=C(C=C3)Cl)OC2=O

Isomeric SMILES

COC(=O)C(CC1=CC=CC=C1)NC(=O)COC(=O)CCN2C3=C(C=C(C=C3)Cl)OC2=O

InChI

InChI=1S/C22H21ClN2O7/c1-30-21(28)16(11-14-5-3-2-4-6-14)24-19(26)13-31-20(27)9-10-25-17-8-7-15(23)12-18(17)32-22(25)29/h2-8,12,16H,9-11,13H2,1H3,(H,24,26)