[2-(azepan-1-yl)-2-oxidanylidene-ethyl] 1,3-benzoxazole-4-carboxylate

Systemtic Name: [2-(azepan-1-yl)-2-oxidanylidene-ethyl] 1,3-benzoxazole-4-carboxylate Openeye Name: [2-(azepan-1-yl)-2-oxo-ethyl] 1,3-benzoxazole-4-carboxylate CAS Name: 1,3-benzoxazole-4-carboxylic acid [2-(1-azepanyl)-2-oxoethyl] ester IUPAC Name: [2-(azepan-1-yl)-2-oxoethyl] 1,3-benzoxazole-4-carboxylate Traditional Name: 1,3-benzoxazole-4-carboxylic acid [2-(azepan-1-yl)-2-keto-ethyl] ester Formula: C16H18N2O4 MolecularWeight: 302.32512

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)COC(=O)C2=C3C(=CC=C2)OC=N3

Isomeric SMILES

C1CCCN(CC1)C(=O)COC(=O)C2=C3C(=CC=C2)OC=N3

InChI

InChI=1S/C16H18N2O4/c19-14(18-8-3-1-2-4-9-18)10-21-16(20)12-6-5-7-13-15(12)17-11-22-13/h5-7,11H,1-4,8-10H2