ethyl 2-[2-[3-(azepan-1-ylsulfonyl)phenyl]carbonyloxyethanoylamino]benzoate

Systemtic Name: ethyl 2-[2-[3-(azepan-1-ylsulfonyl)phenyl]carbonyloxyethanoylamino]benzoate Openeye Name: ethyl 2-[[2-[3-(azepan-1-ylsulfonyl)benzoyl]oxyacetyl]amino]benzoate CAS Name: 2-[[2-[[3-(1-azepanylsulfonyl)phenyl]-oxomethoxy]-1-oxoethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 2-[[2-[3-(azepan-1-ylsulfonyl)benzoyl]oxyacetyl]amino]benzoate Traditional Name: 2-[[2-[3-(azepan-1-ylsulfonyl)benzoyl]oxyacetyl]amino]benzoic acid ethyl ester Formula: C24H28N2O7S MolecularWeight: 488.55332

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=CC=C1NC(=O)COC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

CCOC(=O)C1=CC=CC=C1NC(=O)COC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C24H28N2O7S/c1-2-32-24(29)20-12-5-6-13-21(20)25-22(27)17-33-23(28)18-10-9-11-19(16-18)34(30,31)26-14-7-3-4-8-15-26/h5-6,9-13,16H,2-4,7-8,14-15,17H2,1H3,(H,25,27)