methyl 3-[2-(3-oxidanylidene-4H-1,4-benzoxazin-2-yl)ethanoylamino]-3-thiophen-2-yl-propanoate

Systemtic Name: methyl 3-[2-(3-oxidanylidene-4H-1,4-benzoxazin-2-yl)ethanoylamino]-3-thiophen-2-yl-propanoate Openeye Name: methyl 3-[[2-(3-oxo-4H-1,4-benzoxazin-2-yl)acetyl]amino]-3-(2-thienyl)propanoate CAS Name: 3-[[1-oxo-2-(3-oxo-4H-1,4-benzoxazin-2-yl)ethyl]amino]-3-thiophen-2-ylpropanoic acid methyl ester IUPAC Name: methyl 3-[[2-(3-oxo-4H-1,4-benzoxazin-2-yl)acetyl]amino]-3-thiophen-2-ylpropanoate Traditional Name: 3-[[2-(3-keto-4H-1,4-benzoxazin-2-yl)acetyl]amino]-3-(2-thienyl)propionic acid methyl ester Formula: C18H18N2O5S MolecularWeight: 374.41092

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(C1=CC=CS1)NC(=O)CC2C(=O)NC3=CC=CC=C3O2

Isomeric SMILES

COC(=O)CC(C1=CC=CS1)NC(=O)CC2C(=O)NC3=CC=CC=C3O2

InChI

InChI=1S/C18H18N2O5S/c1-24-17(22)9-12(15-7-4-8-26-15)19-16(21)10-14-18(23)20-11-5-2-3-6-13(11)25-14/h2-8,12,14H,9-10H2,1H3,(H,19,21)(H,20,23)