[1-(azepan-1-yl)-1-oxidanylidene-propan-2-yl] 4-methoxy-2-oxidanyl-benzoate

Systemtic Name: [1-(azepan-1-yl)-1-oxidanylidene-propan-2-yl] 4-methoxy-2-oxidanyl-benzoate Openeye Name: [2-(azepan-1-yl)-1-methyl-2-oxo-ethyl] 2-hydroxy-4-methoxy-benzoate CAS Name: 2-hydroxy-4-methoxybenzoic acid [1-(1-azepanyl)-1-oxopropan-2-yl] ester IUPAC Name: [1-(azepan-1-yl)-1-oxopropan-2-yl] 2-hydroxy-4-methoxybenzoate Traditional Name: 2-hydroxy-4-methoxy-benzoic acid [2-(azepan-1-yl)-2-keto-1-methyl-ethyl] ester Formula: C17H23NO5 MolecularWeight: 321.36822

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCCCCC1)OC(=O)C2=C(C=C(C=C2)OC)O

Isomeric SMILES

CC(C(=O)N1CCCCCC1)OC(=O)C2=C(C=C(C=C2)OC)O

InChI

InChI=1S/C17H23NO5/c1-12(16(20)18-9-5-3-4-6-10-18)23-17(21)14-8-7-13(22-2)11-15(14)19/h7-8,11-12,19H,3-6,9-10H2,1-2H3