(2-thiophen-2-yl-1,3-oxazol-4-yl)methyl 2-(2-oxidanylideneazepan-1-yl)ethanoate

Systemtic Name: (2-thiophen-2-yl-1,3-oxazol-4-yl)methyl 2-(2-oxidanylideneazepan-1-yl)ethanoate Openeye Name: [2-(2-thienyl)oxazol-4-yl]methyl 2-(2-oxoazepan-1-yl)acetate CAS Name: 2-(2-oxo-1-azepanyl)acetic acid (2-thiophen-2-yl-4-oxazolyl)methyl ester IUPAC Name: (2-thiophen-2-yl-1,3-oxazol-4-yl)methyl 2-(2-oxoazepan-1-yl)acetate Traditional Name: 2-(2-ketoazepan-1-yl)acetic acid [2-(2-thienyl)oxazol-4-yl]methyl ester Formula: C16H18N2O4S MolecularWeight: 334.39012

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=O)N(CC1)CC(=O)OCC2=COC(=N2)C3=CC=CS3

Isomeric SMILES

C1CCC(=O)N(CC1)CC(=O)OCC2=COC(=N2)C3=CC=CS3

InChI

InChI=1S/C16H18N2O4S/c19-14-6-2-1-3-7-18(14)9-15(20)21-10-12-11-22-16(17-12)13-5-4-8-23-13/h4-5,8,11H,1-3,6-7,9-10H2